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

Systemtic Name: 3-[2-[(3-chlorophenyl)-propyl-amino]-2-oxidanylidene-ethyl]-1-ethyl-indole-2-carboxylic acid Openeye Name: 3-[2-(3-chloro-N-propyl-anilino)-2-oxo-ethyl]-1-ethyl-indole-2-carboxylic acid CAS Name: 3-[2-(3-chloro-N-propylanilino)-2-oxoethyl]-1-ethyl-2-indolecarboxylic acid IUPAC Name: 3-[2-(3-chloro-N-propylanilino)-2-oxoethyl]-1-ethylindole-2-carboxylic acid Traditional Name: 3-[2-(3-chloro-N-propyl-anilino)-2-keto-ethyl]-1-ethyl-indole-2-carboxylic acid Formula: C22H23ClN2O3 MolecularWeight: 398.88262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN2O3/c1-3-12-25(16-9-7-8-15(23)13-16)20(26)14-18-17-10-5-6-11-19(17)24(4-2)21(18)22(27)28/h5-11,13H,3-4,12,14H2,1-2H3,(H,27,28)