(2S)-2-[(4-cyanophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-[(4-cyanophenyl)carbonylamino]-3-(1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-[(4-cyanobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-[[(4-cyanophenyl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-[(4-cyanobenzoyl)amino]-3-(1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-[(4-cyanobenzoyl)amino]-3-(1H-indol-3-yl)propionic acid Formula: C19H15N3O3 MolecularWeight: 333.3407

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H15N3O3/c20-10-12-5-7-13(8-6-12)18(23)22-17(19(24)25)9-14-11-21-16-4-2-1-3-15(14)16/h1-8,11,17,21H,9H2,(H,22,23)(H,24,25)/t17-/m0/s1