2-(2-methylprop-2-enyl)-2-[1-(4-nitrophenyl)but-3-ynyl]propanedinitrile

Systemtic Name: 2-(2-methylprop-2-enyl)-2-[1-(4-nitrophenyl)but-3-ynyl]propanedinitrile Openeye Name: 2-(2-methylallyl)-2-[1-(4-nitrophenyl)but-3-ynyl]propanedinitrile CAS Name: 2-(2-methylprop-2-enyl)-2-[1-(4-nitrophenyl)but-3-ynyl]propanedinitrile IUPAC Name: 2-(2-methylprop-2-enyl)-2-[1-(4-nitrophenyl)but-3-ynyl]propanedinitrile Traditional Name: 2-(2-methylallyl)-2-[1-(4-nitrophenyl)but-3-ynyl]malononitrile Formula: C17H15N3O2 MolecularWeight: 293.3199

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15N3O2/c1-4-5-16(17(11-18,12-19)10-13(2)3)14-6-8-15(9-7-14)20(21)22/h1,6-9,16H,2,5,10H2,3H3