[4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2-(2-methyl-4-nitro-phenoxy)ethanoate

Systemtic Name: [4-[(E)-2-cyano-3-morpholin-4-yl-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2-(2-methyl-4-nitro-phenoxy)ethanoate Openeye Name: [4-[(E)-2-cyano-3-morpholino-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 2-(2-methyl-4-nitro-phenoxy)acetate CAS Name: 2-(2-methyl-4-nitrophenoxy)acetic acid [4-[(E)-2-cyano-3-(4-morpholinyl)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-morpholin-4-yl-3-oxoprop-1-enyl]-2-methoxyphenyl] 2-(2-methyl-4-nitrophenoxy)acetate Traditional Name: 2-(2-methyl-4-nitro-phenoxy)acetic acid [4-[(E)-2-cyano-3-keto-3-morpholino-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C24H23N3O8 MolecularWeight: 481.45472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)N3CCOCC3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])OCC(=O)OC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)N3CCOCC3)OC

InChI

InChI=1S/C24H23N3O8/c1-16-11-19(27(30)31)4-6-20(16)34-15-23(28)35-21-5-3-17(13-22(21)32-2)12-18(14-25)24(29)26-7-9-33-10-8-26/h3-6,11-13H,7-10,15H2,1-2H3/b18-12+