[4-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 3-(4-ethoxy-3-methoxy-phenyl)propanoate

Systemtic Name: [4-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 3-(4-ethoxy-3-methoxy-phenyl)propanoate Openeye Name: [4-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3-(4-ethoxy-3-methoxy-phenyl)propanoate CAS Name: 3-(4-ethoxy-3-methoxyphenyl)propanoic acid [4-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(2-methoxyethylamino)-3-oxoprop-1-enyl]-2-methoxyphenyl] 3-(4-ethoxy-3-methoxyphenyl)propanoate Traditional Name: 3-(4-ethoxy-3-methoxy-phenyl)propionic acid [4-[(E)-2-cyano-3-keto-3-(2-methoxyethylamino)prop-1-enyl]-2-methoxy-phenyl] ester Formula: C26H30N2O7 MolecularWeight: 482.5256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NCCOC)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)NCCOC)OC)OC

InChI

InChI=1S/C26H30N2O7/c1-5-34-21-9-6-18(15-23(21)32-3)8-11-25(29)35-22-10-7-19(16-24(22)33-4)14-20(17-27)26(30)28-12-13-31-2/h6-7,9-10,14-16H,5,8,11-13H2,1-4H3,(H,28,30)/b20-14+