ethyl (3R)-3-[4-(1-methylindol-3-yl)butanoylamino]-3-(3-nitrophenyl)propanoate

Systemtic Name: ethyl (3R)-3-[4-(1-methylindol-3-yl)butanoylamino]-3-(3-nitrophenyl)propanoate Openeye Name: ethyl (3R)-3-[4-(1-methylindol-3-yl)butanoylamino]-3-(3-nitrophenyl)propanoate CAS Name: (3R)-3-[[4-(1-methyl-3-indolyl)-1-oxobutyl]amino]-3-(3-nitrophenyl)propanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-[4-(1-methylindol-3-yl)butanoylamino]-3-(3-nitrophenyl)propanoate Traditional Name: (3R)-3-[4-(1-methylindol-3-yl)butanoylamino]-3-(3-nitrophenyl)propionic acid ethyl ester Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)CCCC2=CN(C3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])NC(=O)CCCC2=CN(C3=CC=CC=C32)C

InChI

InChI=1S/C24H27N3O5/c1-3-32-24(29)15-21(17-8-6-10-19(14-17)27(30)31)25-23(28)13-7-9-18-16-26(2)22-12-5-4-11-20(18)22/h4-6,8,10-12,14,16,21H,3,7,9,13,15H2,1-2H3,(H,25,28)/t21-/m1/s1