[4-[(Z)-2-cyano-3-(2-methylbutoxy)-3-oxidanylidene-prop-1-enyl]phenyl] 4-dodecoxybenzoate

Systemtic Name: [4-[(Z)-2-cyano-3-(2-methylbutoxy)-3-oxidanylidene-prop-1-enyl]phenyl] 4-dodecoxybenzoate Openeye Name: [4-[(Z)-2-cyano-3-(2-methylbutoxy)-3-oxo-prop-1-enyl]phenyl] 4-dodecoxybenzoate CAS Name: 4-dodecoxybenzoic acid [4-[(Z)-2-cyano-3-(2-methylbutoxy)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(Z)-2-cyano-3-(2-methylbutoxy)-3-oxoprop-1-enyl]phenyl] 4-dodecoxybenzoate Traditional Name: 4-lauryloxybenzoic acid [4-[(Z)-2-cyano-3-keto-3-(2-methylbutoxy)prop-1-enyl]phenyl] ester Formula: C34H45NO5 MolecularWeight: 547.7248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=C(/C#N)\C(=O)OCC(C)CC

InChI

InChI=1S/C34H45NO5/c1-4-6-7-8-9-10-11-12-13-14-23-38-31-21-17-29(18-22-31)34(37)40-32-19-15-28(16-20-32)24-30(25-35)33(36)39-26-27(3)5-2/h15-22,24,27H,4-14,23,26H2,1-3H3/b30-24-