methyl 2-[[2-(3,4-dimethoxyphenyl)-3-oxidanyl-heptanoyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[[2-(3,4-dimethoxyphenyl)-3-oxidanyl-heptanoyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[[2-(3,4-dimethoxyphenyl)-3-hydroxy-heptanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-3-hydroxy-1-oxoheptyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[2-(3,4-dimethoxyphenyl)-3-hydroxyheptanoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[2-(3,4-dimethoxyphenyl)-3-hydroxy-heptanoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C27H34N2O6 MolecularWeight: 482.56866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C1=CC(=C(C=C1)OC)OC)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)O

Isomeric SMILES

CCCCC(C(C1=CC(=C(C=C1)OC)OC)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)O

InChI

InChI=1S/C27H34N2O6/c1-5-6-11-22(30)25(17-12-13-23(33-2)24(15-17)34-3)26(31)29-21(27(32)35-4)14-18-16-28-20-10-8-7-9-19(18)20/h7-10,12-13,15-16,21-22,25,28,30H,5-6,11,14H2,1-4H3,(H,29,31)