(2S)-1-(4-methylphenyl)carbonyl-2,3-dihydroindole-2-carboxylate

Systemtic Name: (2S)-1-(4-methylphenyl)carbonyl-2,3-dihydroindole-2-carboxylate Openeye Name: (2S)-1-(4-methylbenzoyl)indoline-2-carboxylate CAS Name: (2S)-1-[(4-methylphenyl)-oxomethyl]-2,3-dihydroindole-2-carboxylate IUPAC Name: (2S)-1-(4-methylbenzoyl)-2,3-dihydroindole-2-carboxylate Traditional Name: (2S)-1-p-toluoylindoline-2-carboxylate Formula: C17H14NO3- MolecularWeight: 280.29796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CC3=CC=CC=C32)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2[C@@H](CC3=CC=CC=C32)C(=O)[O-]

InChI

InChI=1S/C17H15NO3/c1-11-6-8-12(9-7-11)16(19)18-14-5-3-2-4-13(14)10-15(18)17(20)21/h2-9,15H,10H2,1H3,(H,20,21)/p-1/t15-/m0/s1