[2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] 2-(2-chloranylphenoxy)ethanoate

Systemtic Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxidanylidene-ethyl] 2-(2-chloranylphenoxy)ethanoate Openeye Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxo-ethyl] 2-(2-chlorophenoxy)acetate CAS Name: 2-(2-chlorophenoxy)acetic acid [2-[1-(2-cyanoethyl)-3-indolyl]-2-oxoethyl] ester IUPAC Name: [2-[1-(2-cyanoethyl)indol-3-yl]-2-oxoethyl] 2-(2-chlorophenoxy)acetate Traditional Name: 2-(2-chlorophenoxy)acetic acid [2-[1-(2-cyanoethyl)indol-3-yl]-2-keto-ethyl] ester Formula: C21H17ClN2O4 MolecularWeight: 396.82368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)COC(=O)COC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CCC#N)C(=O)COC(=O)COC3=CC=CC=C3Cl

InChI

InChI=1S/C21H17ClN2O4/c22-17-7-2-4-9-20(17)27-14-21(26)28-13-19(25)16-12-24(11-5-10-23)18-8-3-1-6-15(16)18/h1-4,6-9,12H,5,11,13-14H2