1-(2-methylprop-2-enyl)-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(2-methylprop-2-enyl)-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-(2-methylallyl)-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(2-methylprop-2-enyl)-4-(3-nitrophenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(2-methylprop-2-enyl)-4-(3-nitrophenyl)sulfonylpiperazin-1-ium Traditional Name: 1-(2-methylallyl)-4-(3-nitrophenyl)sulfonyl-piperazin-1-ium Formula: C14H20N3O4S+ MolecularWeight: 326.3913

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O4S/c1-12(2)11-15-6-8-16(9-7-15)22(20,21)14-5-3-4-13(10-14)17(18)19/h3-5,10H,1,6-9,11H2,2H3/p+1