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

Systemtic Name: 5-chloranyl-3-[2-[(3-methylphenyl)-propyl-amino]-2-oxidanylidene-ethyl]-1H-indole-2-carboxylic acid Openeye Name: 5-chloro-3-[2-(3-methyl-N-propyl-anilino)-2-oxo-ethyl]-1H-indole-2-carboxylic acid CAS Name: 5-chloro-3-[2-(3-methyl-N-propylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid IUPAC Name: 5-chloro-3-[2-(3-methyl-N-propylanilino)-2-oxoethyl]-1H-indole-2-carboxylic acid Traditional Name: 5-chloro-3-[2-keto-2-(3-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(=C1)C)C(=O)CC2=C(NC3=C2C=C(C=C3)Cl)C(=O)O

Isomeric SMILES

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

InChI

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