[4-[(E,3E)-3-(3-oxidanylidene-2-phenyl-isoindol-1-ylidene)hex-1-enyl]phenyl] ethanoate

Systemtic Name: [4-[(E,3E)-3-(3-oxidanylidene-2-phenyl-isoindol-1-ylidene)hex-1-enyl]phenyl] ethanoate Openeye Name: [4-[(E,3E)-3-(3-oxo-2-phenyl-isoindolin-1-ylidene)hex-1-enyl]phenyl] acetate CAS Name: acetic acid [4-[(E,3E)-3-(3-oxo-2-phenyl-1-isoindolylidene)hex-1-enyl]phenyl] ester IUPAC Name: [4-[(E,3E)-3-(3-oxo-2-phenylisoindol-1-ylidene)hex-1-enyl]phenyl] acetate Traditional Name: acetic acid [4-[(E,3E)-3-(3-keto-2-phenyl-isoindolin-1-ylidene)hex-1-enyl]phenyl] ester Formula: C28H25NO3 MolecularWeight: 423.503

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=C1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3)C=CC4=CC=C(C=C4)OC(=O)C

Isomeric SMILES

CCC/C(=C\1/C2=CC=CC=C2C(=O)N1C3=CC=CC=C3)/C=C/C4=CC=C(C=C4)OC(=O)C

InChI

InChI=1S/C28H25NO3/c1-3-9-22(17-14-21-15-18-24(19-16-21)32-20(2)30)27-25-12-7-8-13-26(25)28(31)29(27)23-10-5-4-6-11-23/h4-8,10-19H,3,9H2,1-2H3/b17-14+,27-22+