1-[(E)-2-methylbut-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-[(E)-2-methylbut-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-[(E)-2-methylbut-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-[(E)-2-methylbut-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-[(E)-2-methylbut-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-[(E)-2-methylbut-2-enyl]-4-(4-nitrophenyl)piperazin-1-ium Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21N3O2/c1-3-13(2)12-16-8-10-17(11-9-16)14-4-6-15(7-5-14)18(19)20/h3-7H,8-12H2,1-2H3/p+1/b13-3+