[1-(4-cyanophenyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-yl] ethanoate

Systemtic Name: [1-(4-cyanophenyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-yl] ethanoate Openeye Name: [1-(4-cyanophenyl)-4-oxo-cyclohexa-2,5-dien-1-yl] acetate CAS Name: acetic acid [1-(4-cyanophenyl)-4-oxo-1-cyclohexa-2,5-dienyl] ester IUPAC Name: [1-(4-cyanophenyl)-4-oxocyclohexa-2,5-dien-1-yl] acetate Traditional Name: acetic acid [1-(4-cyanophenyl)-4-keto-cyclohexa-2,5-dien-1-yl] ester Formula: C15H11NO3 MolecularWeight: 253.25274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(C=CC(=O)C=C1)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(=O)OC1(C=CC(=O)C=C1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H11NO3/c1-11(17)19-15(8-6-14(18)7-9-15)13-4-2-12(10-16)3-5-13/h2-9H,1H3