1-(4-nitrophenyl)sulfonyl-4-(3-phenoxypropyl)piperazin-4-ium

Systemtic Name: 1-(4-nitrophenyl)sulfonyl-4-(3-phenoxypropyl)piperazin-4-ium Openeye Name: 1-(4-nitrophenyl)sulfonyl-4-(3-phenoxypropyl)piperazin-4-ium CAS Name: 1-(4-nitrophenyl)sulfonyl-4-(3-phenoxypropyl)piperazin-4-ium IUPAC Name: 1-(4-nitrophenyl)sulfonyl-4-(3-phenoxypropyl)piperazin-4-ium Traditional Name: 1-nosyl-4-(3-phenoxypropyl)piperazin-4-ium Formula: C19H24N3O5S+ MolecularWeight: 406.47596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCOC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CCCOC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O5S/c23-22(24)17-7-9-19(10-8-17)28(25,26)21-14-12-20(13-15-21)11-4-16-27-18-5-2-1-3-6-18/h1-3,5-10H,4,11-16H2/p+1