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

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) (E)-3-(3-phenoxyphenyl)prop-2-enoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) (E)-3-(3-phenoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3-phenoxyphenyl)-2-propenoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) (E)-3-(3-phenoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-phenoxyphenyl)acrylic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C21H18N2O4 MolecularWeight: 362.37862

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)OC2=CC=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)/C=C/C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H18N2O4/c1-15(23)19(13-22)20(24)14-26-21(25)11-10-16-6-5-9-18(12-16)27-17-7-3-2-4-8-17/h2-12,19,23H,14H2,1H3/b11-10+,23-15?