3-[2-[(3-chlorophenyl)-ethyl-amino]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid

Systemtic Name: 3-[2-[(3-chlorophenyl)-ethyl-amino]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid Openeye Name: 3-[2-(3-chloro-N-ethyl-anilino)-2-oxo-ethyl]-1-ethyl-indole-2-carboxylic acid CAS Name: 3-[2-(3-chloro-N-ethylanilino)-2-oxoethyl]-1-ethyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(3-chloro-N-ethylanilino)-2-oxoethyl]-1-ethylindole-2-carboxylic acid Traditional Name: 3-[2-(3-chloro-N-ethyl-anilino)-2-keto-ethyl]-1-ethyl-indole-2-carboxylic acid Formula: C21H21ClN2O3 MolecularWeight: 384.85604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N(CC)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C1C(=O)O)CC(=O)N(CC)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H21ClN2O3/c1-3-23(15-9-7-8-14(22)12-15)19(25)13-17-16-10-5-6-11-18(16)24(4-2)20(17)21(26)27/h5-12H,3-4,13H2,1-2H3,(H,26,27)