(Z)-3-(3,4-diethoxyphenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(3,4-diethoxyphenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile Openeye Name: (Z)-3-(3,4-diethoxyphenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)prop-2-enenitrile CAS Name: (Z)-3-(3,4-diethoxyphenyl)-2-(4,5-dimethoxy-2-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-(3,4-diethoxyphenyl)-2-(4,5-dimethoxy-2-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(3,4-diethoxyphenyl)-2-(4,5-dimethoxy-2-nitro-phenyl)acrylonitrile Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C(C#N)C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=CC(=C(C=C2[N+](=O)[O-])OC)OC)OCC

InChI

InChI=1S/C21H22N2O6/c1-5-28-18-8-7-14(10-21(18)29-6-2)9-15(13-22)16-11-19(26-3)20(27-4)12-17(16)23(24)25/h7-12H,5-6H2,1-4H3/b15-9+