2-[(3,4-diethoxyphenyl)carbonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(3,4-diethoxyphenyl)carbonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(3,4-diethoxybenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[(3,4-diethoxyphenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(3,4-diethoxybenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(3,4-diethoxybenzoyl)amino]-3-(1H-indol-3-yl)propionic acid Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O)OCC

InChI

InChI=1S/C22H24N2O5/c1-3-28-19-10-9-14(12-20(19)29-4-2)21(25)24-18(22(26)27)11-15-13-23-17-8-6-5-7-16(15)17/h5-10,12-13,18,23H,3-4,11H2,1-2H3,(H,24,25)(H,26,27)