[4-butoxy-3-cyano-2-(methylideneamino)phenyl] 4-[(E)-2-(4-propylcyclohexyl)ethenyl]benzoate

Systemtic Name: [4-butoxy-3-cyano-2-(methylideneamino)phenyl] 4-[(E)-2-(4-propylcyclohexyl)ethenyl]benzoate Openeye Name: [4-butoxy-3-cyano-2-(methyleneamino)phenyl] 4-[(E)-2-(4-propylcyclohexyl)vinyl]benzoate CAS Name: 4-[(E)-2-(4-propylcyclohexyl)ethenyl]benzoic acid [4-butoxy-3-cyano-2-(methyleneamino)phenyl] ester IUPAC Name: [4-butoxy-3-cyano-2-(methylideneamino)phenyl] 4-[(E)-2-(4-propylcyclohexyl)ethenyl]benzoate Traditional Name: 4-[(E)-2-(4-propylcyclohexyl)vinyl]benzoic acid [4-butoxy-3-cyano-2-(methyleneamino)phenyl] ester Formula: C30H36N2O3 MolecularWeight: 472.61844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C=C1)OC(=O)C2=CC=C(C=C2)C=CC3CCC(CC3)CCC)N=C)C#N

Isomeric SMILES

CCCCOC1=C(C(=C(C=C1)OC(=O)C2=CC=C(C=C2)/C=C/C3CCC(CC3)CCC)N=C)C#N

InChI

InChI=1S/C30H36N2O3/c1-4-6-20-34-27-18-19-28(29(32-3)26(27)21-31)35-30(33)25-16-14-24(15-17-25)13-12-23-10-8-22(7-5-2)9-11-23/h12-19,22-23H,3-11,20H2,1-2H3/b13-12+