1-methyl-3-[2-[(3-methylphenyl)-propyl-amino]-2-oxidanylidene-ethyl]indole-2-carboxylic acid

Systemtic Name: 1-methyl-3-[2-[(3-methylphenyl)-propyl-amino]-2-oxidanylidene-ethyl]indole-2-carboxylic acid Openeye Name: 1-methyl-3-[2-(3-methyl-N-propyl-anilino)-2-oxo-ethyl]indole-2-carboxylic acid CAS Name: 1-methyl-3-[2-(3-methyl-N-propylanilino)-2-oxoethyl]-2-indolecarboxylic acid IUPAC Name: 1-methyl-3-[2-(3-methyl-N-propylanilino)-2-oxoethyl]indole-2-carboxylic acid Traditional Name: 3-[2-keto-2-(3-methyl-N-propyl-anilino)ethyl]-1-methyl-indole-2-carboxylic acid Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC(=C1)C)C(=O)CC2=C(N(C3=CC=CC=C32)C)C(=O)O

Isomeric SMILES

CCCN(C1=CC=CC(=C1)C)C(=O)CC2=C(N(C3=CC=CC=C32)C)C(=O)O

InChI

InChI=1S/C22H24N2O3/c1-4-12-24(16-9-7-8-15(2)13-16)20(25)14-18-17-10-5-6-11-19(17)23(3)21(18)22(26)27/h5-11,13H,4,12,14H2,1-3H3,(H,26,27)