ethyl 2-[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetate CAS Name: 2-[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(E)-2-cyano-3-(3-nitrophenyl)-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetate Traditional Name: 2-[4-[(E)-2-cyano-3-keto-3-(3-nitrophenyl)prop-1-enyl]-2-methoxy-phenoxy]acetic acid ethyl ester Formula: C21H18N2O7 MolecularWeight: 410.37682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=C(C=C(C=C1)C=C(C#N)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCOC(=O)COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C2=CC(=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C21H18N2O7/c1-3-29-20(24)13-30-18-8-7-14(10-19(18)28-2)9-16(12-22)21(25)15-5-4-6-17(11-15)23(26)27/h4-11H,3,13H2,1-2H3/b16-9+