(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate CAS Name: (E)-2-(4-chlorophenyl)-3-phenyl-2-propenoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (E)-2-(4-chlorophenyl)-3-phenylprop-2-enoate Traditional Name: (E)-2-(4-chlorophenyl)-3-phenyl-acrylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C21H17ClN2O3 MolecularWeight: 380.82428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C(=CC1=CC=CC=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)/C(=C/C1=CC=CC=C1)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H17ClN2O3/c1-14(24)19(12-23)20(25)13-27-21(26)18(11-15-5-3-2-4-6-15)16-7-9-17(22)10-8-16/h2-11,19,24H,13H2,1H3/b18-11+,24-14?