[4-[(E)-2-cyano-3-[(2-ethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] cyclohexanecarboxylate

Systemtic Name: [4-[(E)-2-cyano-3-[(2-ethylphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] cyclohexanecarboxylate Openeye Name: [4-[(E)-2-cyano-3-(2-ethylanilino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [4-[(E)-2-cyano-3-(2-ethylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(2-ethylanilino)-3-oxoprop-1-enyl]-2-methoxyphenyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [4-[(E)-2-cyano-3-(2-ethylanilino)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3CCCCC3)OC)C#N

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)/C(=C/C2=CC(=C(C=C2)OC(=O)C3CCCCC3)OC)/C#N

InChI

InChI=1S/C26H28N2O4/c1-3-19-9-7-8-12-22(19)28-25(29)21(17-27)15-18-13-14-23(24(16-18)31-2)32-26(30)20-10-5-4-6-11-20/h7-9,12-16,20H,3-6,10-11H2,1-2H3,(H,28,29)/b21-15+