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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1C)C(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCCN(C1=CC=CC=C1C)C(=O)CC2=C(NC3=CC=CC=C32)C(=O)O

InChI

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