[4-[(E)-3-[(4-butylphenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]-2,6-dimethoxy-phenyl] ethanoate

Systemtic Name: [4-[(E)-3-[(4-butylphenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]-2,6-dimethoxy-phenyl] ethanoate Openeye Name: [4-[(E)-3-(4-butylanilino)-2-cyano-3-oxo-prop-1-enyl]-2,6-dimethoxy-phenyl] acetate CAS Name: acetic acid [4-[(E)-3-(4-butylanilino)-2-cyano-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] ester IUPAC Name: [4-[(E)-3-(4-butylanilino)-2-cyano-3-oxoprop-1-enyl]-2,6-dimethoxyphenyl] acetate Traditional Name: acetic acid [4-[(E)-3-(4-butylanilino)-2-cyano-3-keto-prop-1-enyl]-2,6-dimethoxy-phenyl] ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C(=C2)OC)OC(=O)C)OC)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC(=C(C(=C2)OC)OC(=O)C)OC)/C#N

InChI

InChI=1S/C24H26N2O5/c1-5-6-7-17-8-10-20(11-9-17)26-24(28)19(15-25)12-18-13-21(29-3)23(31-16(2)27)22(14-18)30-4/h8-14H,5-7H2,1-4H3,(H,26,28)/b19-12+