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

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[(3-methylphenyl)carbonylamino]propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-[(3-methylbenzoyl)amino]propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[(3-methylbenzoyl)amino]propanoic acid Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(m-toluoylamino)propionic acid Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C19H18N2O3/c1-12-5-4-6-13(9-12)18(22)21-17(19(23)24)10-14-11-20-16-8-3-2-7-15(14)16/h2-9,11,17,20H,10H2,1H3,(H,21,22)(H,23,24)/t17-/m0/s1