Formula |
C40H35N2O6P |
IUPAC Name |
n-methyl-2-[(2r)-2-phosphonatobutanoyl]-n-[1-[(e)-2-vinylbut-2-enoyl]-4-piperidyl]benzamide |
Molecular Mass |
670.689 g·mol−1 |
Heat of Formation |
-768.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.40 ± 1.08 D |
Volume |
783.66 Å 3 |
Surface Area |
620.3 Å 2 |
HOMO Energy |
-8.74 ± 0.55 eV |
LUMO Energy |
-1.27 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-[3-({methyl[1-(2-naphthoyl)piperidin-4-yl]amino}carbonyl)-2-naphthyl]-1-(1-naphthyl)-2-oxoethylphosphonic acid
- [(1r)-2-[3-[[methyl-[1-(2-naphthyl-oxomethyl)-4-piperidinyl]amino]-oxomethyl]-2-naphthyl]-1-(1-naphthyl)-2-oxoethyl]phosphonic acid
- [(1r)-2-[3-[methyl-(1-naphthalen-2-ylcarbonylpiperidin-4-yl)carbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxo-ethyl]phosphonic acid
- [(1r)-2-[3-[methyl-[1-(naphthalene-2-carbonyl)-4-piperidyl]carbamoyl]-2-naphthyl]-1-(1-naphthyl)-2-oxo-ethyl]phosphonic acid
- [(1r)-2-[3-[methyl-[1-(naphthalene-2-carbonyl)piperidin-4-yl]carbamoyl]naphthalen-2-yl]-1-naphthalen-1-yl-2-oxoethyl]phosphonic acid
- [(1r)-2-keto-2-[3-[methyl-[1-(naphthalene-2-carbonyl)-4-piperidyl]carbamoyl]-2-naphthyl]-1-(1-naphthyl)ethyl]phosphonic acid
- ohh
|
InChIKey |
XUJQPDQURBZEGJ-KXQOOQHDSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
N
O
P
|
|
|