2-[5-(3-chlorophenyl)-1-(cyclobutylmethyl)indol-3-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[5-(3-chlorophenyl)-1-(cyclobutylmethyl)indol-3-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[5-(3-chlorophenyl)-1-(cyclobutylmethyl)indol-3-yl]-2-oxo-acetic acid CAS Name: 2-[5-(3-chlorophenyl)-1-(cyclobutylmethyl)-3-indolyl]-2-oxoacetic acid IUPAC Name: 2-[5-(3-chlorophenyl)-1-(cyclobutylmethyl)indol-3-yl]-2-oxoacetic acid Traditional Name: 2-[5-(3-chlorophenyl)-1-(cyclobutylmethyl)indol-3-yl]-2-keto-acetic acid Formula: C21H18ClNO3 MolecularWeight: 367.82552

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)CN2C=C(C3=C2C=CC(=C3)C4=CC(=CC=C4)Cl)C(=O)C(=O)O

Isomeric SMILES

C1CC(C1)CN2C=C(C3=C2C=CC(=C3)C4=CC(=CC=C4)Cl)C(=O)C(=O)O

InChI

InChI=1S/C21H18ClNO3/c22-16-6-2-5-14(9-16)15-7-8-19-17(10-15)18(20(24)21(25)26)12-23(19)11-13-3-1-4-13/h2,5-10,12-13H,1,3-4,11H2,(H,25,26)