methyl (2S)-2-[(1-ethanoyl-2,3-dihydroindol-5-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(1-ethanoyl-2,3-dihydroindol-5-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(1-acetylindoline-5-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(1-acetyl-2,3-dihydroindol-5-yl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1-acetyl-2,3-dihydroindole-5-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(1-acetylindoline-5-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H22N2O4/c1-14(24)23-11-10-16-13-17(8-9-19(16)23)20(25)22-18(21(26)27-2)12-15-6-4-3-5-7-15/h3-9,13,18H,10-12H2,1-2H3,(H,22,25)/t18-/m0/s1