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

Systemtic Name: 5-chloranyl-3-[2-[(2-methylphenyl)-propyl-amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-(2-methyl-N-propyl-anilino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-(2-methyl-N-propylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-(2-methyl-N-propylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-keto-2-(2-methyl-N-propyl-anilino)ethyl]-1H-indole-2-carboxylic acid Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=CC=C1C)C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCN(C1=CC=CC=C1C)C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H21ClN2O3/c1-3-10-24(18-7-5-4-6-13(18)2)19(25)12-16-15-11-14(22)8-9-17(15)23-20(16)21(26)27/h4-9,11,23H,3,10,12H2,1-2H3,(H,26,27)