[4-[(E)-2-cyano-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]phenyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [4-[(E)-2-cyano-4,4-dimethyl-3-oxidanylidene-pent-1-enyl]phenyl] 3,4,5-trimethoxybenzoate Openeye Name: [4-[(E)-2-cyano-4,4-dimethyl-3-oxo-pent-1-enyl]phenyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [4-[(E)-2-cyano-4,4-dimethyl-3-oxopent-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-2-cyano-4,4-dimethyl-3-oxopent-1-enyl]phenyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [4-[(E)-2-cyano-3-keto-4,4-dimethyl-pent-1-enyl]phenyl] ester Formula: C24H25NO6 MolecularWeight: 423.4584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=CC1=CC=C(C=C1)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C#N

Isomeric SMILES

CC(C)(C)C(=O)/C(=C/C1=CC=C(C=C1)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC)/C#N

InChI

InChI=1S/C24H25NO6/c1-24(2,3)22(26)17(14-25)11-15-7-9-18(10-8-15)31-23(27)16-12-19(28-4)21(30-6)20(13-16)29-5/h7-13H,1-6H3/b17-11+