(E)-2-(4-chlorophenyl)carbonyl-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(4-chlorophenyl)carbonyl-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enenitrile Openeye Name: (E)-2-(4-chlorobenzoyl)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enenitrile CAS Name: (E)-2-[(4-chlorophenyl)-oxomethyl]-3-[4-(dimethylamino)-3-nitrophenyl]-2-propenenitrile IUPAC Name: (E)-2-(4-chlorobenzoyl)-3-[4-(dimethylamino)-3-nitrophenyl]prop-2-enenitrile Traditional Name: (E)-2-(4-chlorobenzoyl)-3-[4-(dimethylamino)-3-nitro-phenyl]acrylonitrile Formula: C18H14ClN3O3 MolecularWeight: 355.77506

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C=C(C#N)C(=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClN3O3/c1-21(2)16-8-3-12(10-17(16)22(24)25)9-14(11-20)18(23)13-4-6-15(19)7-5-13/h3-10H,1-2H3/b14-9+