1-methyl-4-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-3-(4-nitrophenyl)sulfonyl-propyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-3-(4-nitrophenyl)sulfonyl-propyl]piperazine-1,4-diium Openeye Name: 1-methyl-4-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-3-(4-nitrophenyl)sulfonyl-propyl]piperazine-1,4-diium CAS Name: 1-methyl-4-[(2R)-2-(4-methyl-1-piperazine-1,4-diiumyl)-3-(4-nitrophenyl)sulfonylpropyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-3-(4-nitrophenyl)sulfonylpropyl]piperazine-1,4-diium Traditional Name: 1-methyl-4-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-3-nosyl-propyl]piperazine-1,4-diium Formula: C19H35N5O4S+4 MolecularWeight: 429.5773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC(CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CC[NH+](CC3)C

Isomeric SMILES

C[NH+]1CC[NH+](CC1)C[C@H](CS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C19H31N5O4S/c1-20-7-11-22(12-8-20)15-18(23-13-9-21(2)10-14-23)16-29(27,28)19-5-3-17(4-6-19)24(25)26/h3-6,18H,7-16H2,1-2H3/p+4/t18-/m1/s1