(E)-3-[4-(dimethylamino)-3-nitro-phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-(dimethylamino)-3-nitro-phenyl]-2-thiophen-2-ylcarbonyl-prop-2-enenitrile Openeye Name: (E)-3-[4-(dimethylamino)-3-nitro-phenyl]-2-(thiophene-2-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[4-(dimethylamino)-3-nitrophenyl]-2-[oxo(thiophen-2-yl)methyl]-2-propenenitrile IUPAC Name: (E)-3-[4-(dimethylamino)-3-nitrophenyl]-2-(thiophene-2-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[4-(dimethylamino)-3-nitro-phenyl]-2-(2-thenoyl)acrylonitrile Formula: C16H13N3O3S MolecularWeight: 327.35772

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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=CS2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)/C=C(\C#N)/C(=O)C2=CC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S/c1-18(2)13-6-5-11(9-14(13)19(21)22)8-12(10-17)16(20)15-4-3-7-23-15/h3-9H,1-2H3/b12-8+