(Z)-3-(dimethylamino)-2-(4-methoxy-2-nitro-phenyl)carbonyl-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (Z)-3-(dimethylamino)-2-(4-methoxy-2-nitro-phenyl)carbonyl-3-oxidanyl-prop-2-enenitrile Openeye Name: (Z)-3-(dimethylamino)-3-hydroxy-2-(4-methoxy-2-nitro-benzoyl)prop-2-enenitrile CAS Name: (Z)-3-(dimethylamino)-3-hydroxy-2-[(4-methoxy-2-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (Z)-3-(dimethylamino)-3-hydroxy-2-(4-methoxy-2-nitrobenzoyl)prop-2-enenitrile Traditional Name: (Z)-3-(dimethylamino)-3-hydroxy-2-(4-methoxy-2-nitro-benzoyl)acrylonitrile Formula: C13H13N3O5 MolecularWeight: 291.25942

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=C(C#N)C(=O)C1=C(C=C(C=C1)OC)[N+](=O)[O-])O

Isomeric SMILES

CN(C)/C(=C(\C#N)/C(=O)C1=C(C=C(C=C1)OC)[N+](=O)[O-])/O

InChI

InChI=1S/C13H13N3O5/c1-15(2)13(18)10(7-14)12(17)9-5-4-8(21-3)6-11(9)16(19)20/h4-6,18H,1-3H3/b13-10-