1-(3-methylbut-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium

Systemtic Name: 1-(3-methylbut-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium Openeye Name: 1-(3-methylbut-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium CAS Name: 1-(3-methylbut-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium IUPAC Name: 1-(3-methylbut-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium Traditional Name: 1-(3-methylbut-2-enyl)-4-(4-nitrophenyl)piperazin-1-ium Formula: C15H22N3O2+ MolecularWeight: 276.35408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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