methyl (2S)-2-[(1-methylindol-4-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(1-methylindol-4-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(1-methylindole-4-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(1-methyl-4-indolyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1-methylindole-4-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(1-methylindole-4-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C(C=CC=C21)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CN1C=CC2=C(C=CC=C21)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H20N2O3/c1-22-12-11-15-16(9-6-10-18(15)22)19(23)21-17(20(24)25-2)13-14-7-4-3-5-8-14/h3-12,17H,13H2,1-2H3,(H,21,23)/t17-/m0/s1