3-[2-[(2-methoxy-5-methyl-phenyl)-methyl-amino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(2-methoxy-5-methyl-phenyl)-methyl-amino]-2-oxidanylidene-ethyl]-1-methyl-indole-2-carboxylic acid Openeye Name: 3-[2-(2-methoxy-N,5-dimethyl-anilino)-2-oxo-ethyl]-1-methyl-indole-2-carboxylic acid CAS Name: 3-[2-(2-methoxy-N,5-dimethylanilino)-2-oxoethyl]-1-methyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(2-methoxy-N,5-dimethylanilino)-2-oxoethyl]-1-methylindole-2-carboxylic acid Traditional Name: 3-[2-keto-2-(2-methoxy-N,5-dimethyl-anilino)ethyl]-1-methyl-indole-2-carboxylic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N(C)C(=O)CC2=C(N(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N(C)C(=O)CC2=C(N(C3=CC=CC=C32)C)C(=O)O

InChI

InChI=1S/C21H22N2O4/c1-13-9-10-18(27-4)17(11-13)22(2)19(24)12-15-14-7-5-6-8-16(14)23(3)20(15)21(25)26/h5-11H,12H2,1-4H3,(H,25,26)