(Z)-2-(3,4-dimethoxyphenyl)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enenitrile Openeye Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(4-morpholino-3-nitro-phenyl)prop-2-enenitrile CAS Name: (Z)-2-(3,4-dimethoxyphenyl)-3-[4-(4-morpholinyl)-3-nitrophenyl]-2-propenenitrile IUPAC Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-2-(3,4-dimethoxyphenyl)-3-(4-morpholino-3-nitro-phenyl)acrylonitrile Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=CC2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C(=C/C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])/C#N)OC

InChI

InChI=1S/C21H21N3O5/c1-27-20-6-4-16(13-21(20)28-2)17(14-22)11-15-3-5-18(19(12-15)24(25)26)23-7-9-29-10-8-23/h3-6,11-13H,7-10H2,1-2H3/b17-11+