(E)-3-(dimethylamino)-2-(4-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(dimethylamino)-2-(4-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(dimethylamino)-2-(4-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(dimethylamino)-2-[(4-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(dimethylamino)-2-(4-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(dimethylamino)-2-(4-nitrobenzoyl)acrylonitrile Formula: C12H11N3O3 MolecularWeight: 245.23404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O3/c1-14(2)8-10(7-13)12(16)9-3-5-11(6-4-9)15(17)18/h3-6,8H,1-2H3/b10-8+