2-[(4-ethanoylphenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(4-ethanoylphenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: 2-[(4-acetylphenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid CAS Name: 2-[[(4-acetylanilino)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(4-acetylphenyl)carbamoylamino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: 2-[(4-acetylphenyl)carbamoylamino]-3-(1H-indol-3-yl)propionic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O4/c1-12(24)13-6-8-15(9-7-13)22-20(27)23-18(19(25)26)10-14-11-21-17-5-3-2-4-16(14)17/h2-9,11,18,21H,10H2,1H3,(H,25,26)(H2,22,23,27)