(2-cyano-4-oxidanylidene-3,5,6-triphenyl-cyclohexa-2,5-dien-1-yl) ethanoate

Systemtic Name: (2-cyano-4-oxidanylidene-3,5,6-triphenyl-cyclohexa-2,5-dien-1-yl) ethanoate Openeye Name: (2-cyano-4-oxo-3,5,6-triphenyl-cyclohexa-2,5-dien-1-yl) acetate CAS Name: acetic acid (2-cyano-4-oxo-3,5,6-triphenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (2-cyano-4-oxo-3,5,6-triphenylcyclohexa-2,5-dien-1-yl) acetate Traditional Name: acetic acid (2-cyano-4-keto-3,5,6-triphenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C27H19NO3 MolecularWeight: 405.44466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(=C(C(=O)C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CC(=O)OC1C(=C(C(=O)C(=C1C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C27H19NO3/c1-18(29)31-27-22(17-28)23(19-11-5-2-6-12-19)26(30)24(20-13-7-3-8-14-20)25(27)21-15-9-4-10-16-21/h2-16,27H,1H3