4-[[4-[(Z)-2-cyano-3-[(4-methoxyphenyl)methylamino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-6-prop-2-enyl-phenoxy]methyl]benzoate

Systemtic Name: 4-[[4-[(Z)-2-cyano-3-[(4-methoxyphenyl)methylamino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-6-prop-2-enyl-phenoxy]methyl]benzoate Openeye Name: 4-[[2-allyl-4-[(Z)-2-cyano-3-[(4-methoxyphenyl)methylamino]-3-oxo-prop-1-enyl]-6-ethoxy-phenoxy]methyl]benzoate CAS Name: 4-[[4-[(Z)-2-cyano-3-[(4-methoxyphenyl)methylamino]-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]methyl]benzoate IUPAC Name: 4-[[4-[(Z)-2-cyano-3-[(4-methoxyphenyl)methylamino]-3-oxoprop-1-enyl]-2-ethoxy-6-prop-2-enylphenoxy]methyl]benzoate Traditional Name: 4-[[2-allyl-4-[(Z)-2-cyano-3-keto-3-(p-anisylamino)prop-1-enyl]-6-ethoxy-phenoxy]methyl]benzoate Formula: C31H29N2O6- MolecularWeight: 525.57176

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)[O-])CC=C)C=C(C#N)C(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)C(=O)[O-])CC=C)/C=C(/C#N)\C(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C31H30N2O6/c1-4-6-25-15-23(16-26(18-32)30(34)33-19-21-9-13-27(37-3)14-10-21)17-28(38-5-2)29(25)39-20-22-7-11-24(12-8-22)31(35)36/h4,7-17H,1,5-6,19-20H2,2-3H3,(H,33,34)(H,35,36)/p-1/b26-16-