[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid [2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl] ester Formula: C21H20ClNO3S MolecularWeight: 401.9064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CCSC3=CC=CC=C3Cl

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CCSC3=CC=CC=C3Cl

InChI

InChI=1S/C21H20ClNO3S/c1-2-14-6-5-7-15-16(12-23-21(14)15)18(24)13-26-20(25)10-11-27-19-9-4-3-8-17(19)22/h3-9,12,23H,2,10-11,13H2,1H3