[4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]-(4-nitrophenyl)methanone Openeye Name: [4-(2-methylallyl)piperazin-4-ium-1-yl]-(4-nitrophenyl)methanone CAS Name: [4-(2-methylprop-2-enyl)-1-piperazin-4-iumyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(2-methylprop-2-enyl)piperazin-4-ium-1-yl]-(4-nitrophenyl)methanone Traditional Name: [4-(2-methylallyl)piperazin-4-ium-1-yl]-(4-nitrophenyl)methanone Formula: C15H20N3O3+ MolecularWeight: 290.3376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=C)C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O3/c1-12(2)11-16-7-9-17(10-8-16)15(19)13-3-5-14(6-4-13)18(20)21/h3-6H,1,7-11H2,2H3/p+1