methyl 3-(4-methylphenyl)-3-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-(4-methylphenyl)-3-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]propanoate Openeye Name: methyl 3-[(1-methylsulfonylindoline-5-carbonyl)amino]-3-(p-tolyl)propanoate CAS Name: 3-(4-methylphenyl)-3-[[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-methylphenyl)-3-[(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)amino]propanoate Traditional Name: 3-[(1-mesylindoline-5-carbonyl)amino]-3-(p-tolyl)propionic acid methyl ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC3=C(C=C2)N(CC3)S(=O)(=O)C

InChI

InChI=1S/C21H24N2O5S/c1-14-4-6-15(7-5-14)18(13-20(24)28-2)22-21(25)17-8-9-19-16(12-17)10-11-23(19)29(3,26)27/h4-9,12,18H,10-11,13H2,1-3H3,(H,22,25)