4-[[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(2,3-dimethyl-1H-indol-5-yl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(2,3-dimethyl-1H-indole-5-carbonyl)amino]methyl]benzoate CAS Name: 4-[[[(2,3-dimethyl-1H-indol-5-yl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(2,3-dimethyl-1H-indole-5-carbonyl)amino]methyl]benzoate Traditional Name: 4-[[(2,3-dimethyl-1H-indole-5-carbonyl)amino]methyl]benzoate Formula: C19H17N2O3- MolecularWeight: 321.34988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)[O-])C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)[O-])C

InChI

InChI=1S/C19H18N2O3/c1-11-12(2)21-17-8-7-15(9-16(11)17)18(22)20-10-13-3-5-14(6-4-13)19(23)24/h3-9,21H,10H2,1-2H3,(H,20,22)(H,23,24)/p-1