1-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-indan-2-yl-4-(4-nitrophenyl)sulfonyl-piperazin-1-ium CAS Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-(2,3-dihydro-1H-inden-2-yl)-4-(4-nitrophenyl)sulfonylpiperazin-1-ium Traditional Name: 1-indan-2-yl-4-nosyl-piperazin-1-ium Formula: C19H22N3O4S+ MolecularWeight: 388.46068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2CC3=CC=CC=C3C2)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C2CC3=CC=CC=C3C2)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O4S/c23-22(24)17-5-7-19(8-6-17)27(25,26)21-11-9-20(10-12-21)18-13-15-3-1-2-4-16(15)14-18/h1-8,18H,9-14H2/p+1