1-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-(2-methylallyl)-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-(2-methylprop-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-(2-methylallyl)-4-(4-nitrophenyl)piperazin-1-ium Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O2/c1-12(2)11-15-7-9-16(10-8-15)13-3-5-14(6-4-13)17(18)19/h3-6H,1,7-11H2,2H3/p+1