Formula |
C22H26N3O3+ |
IUPAC Name |
2-[[3-(aminomethyl)-2-isobutyl-1-oxo-4-phenyl-2h-isoquinolin-2-ium-6-yl]oxy]acetamide |
Molecular Mass |
380.460 g·mol−1 |
Heat of Formation |
-340.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
0.71 ± 1.08 D |
Volume |
460.61 Å 3 |
Surface Area |
390.49 Å 2 |
HOMO Energy |
-8.49 ± 0.55 eV |
LUMO Energy |
2.57 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[3-(aminomethyl)-2-(2-methylpropyl)-1-oxo-4-phenyl-isoquinolin-6-yl]oxyethanamide
- 2-[[3-(aminomethyl)-2-isobutyl-1-keto-4-phenyl-6-isoquinolyl]oxy]acetamide
- 2-[[3-(aminomethyl)-2-isobutyl-1-oxo-4-phenyl-6-isoquinolyl]oxy]acetamide
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InChIKey |
GODOFGUHKFCHSR-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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