3-[2-[methyl-(4-propan-2-ylphenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-[2-[methyl-(4-propan-2-ylphenyl)amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 3-[2-(4-isopropyl-N-methyl-anilino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 3-[2-(N-methyl-4-propan-2-ylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-[2-(N-methyl-4-propan-2-ylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 3-[2-(4-isopropyl-N-methyl-anilino)-2-keto-ethyl]-1H-indole-2-carboxylic acid Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(C)C(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(C)C(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C21H22N2O3/c1-13(2)14-8-10-15(11-9-14)23(3)19(24)12-17-16-6-4-5-7-18(16)22-20(17)21(25)26/h4-11,13,22H,12H2,1-3H3,(H,25,26)