Formula |
C27H24N2O4 |
IUPAC Name |
2-[2-phenyl-4-[[(1s)-1-phenylpropyl]carbamoyl]quinolin-1-ium-3-id-3-yl]oxyacetate |
Molecular Mass |
440.490 g·mol−1 |
Heat of Formation |
-327.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.33 ± 1.08 D |
Volume |
531.02 Å 3 |
Surface Area |
414.21 Å 2 |
HOMO Energy |
-9.37 ± 0.55 eV |
LUMO Energy |
1.79 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-[2-phenyl-4-[[(1s)-1-phenylpropyl]carbamoyl]quinolin-3-yl]oxyacetic acid
- 2-[2-phenyl-4-[[(1s)-1-phenylpropyl]carbamoyl]quinolin-3-yl]oxyethanoic acid
- 2-[[2-phenyl-4-[[(1s)-1-phenylpropyl]carbamoyl]-3-quinolyl]oxy]acetic acid
- 2-[[4-[oxo-[[(1s)-1-phenylpropyl]amino]methyl]-2-phenyl-3-quinolyl]oxy]acetic acid
- pdsp1_000973
- pdsp2_000957
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InChIKey |
RJIWGNBRTQFKBW-NRFANRHFSA-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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