1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium Openeye Name: 1-indan-5-ylsulfonyl-4-(1-naphthylmethyl)piperazin-4-ium CAS Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(1-naphthalenylmethyl)piperazin-4-ium IUPAC Name: 1-(2,3-dihydro-1H-inden-5-ylsulfonyl)-4-(naphthalen-1-ylmethyl)piperazin-4-ium Traditional Name: 1-indan-5-ylsulfonyl-4-(1-naphthylmethyl)piperazin-4-ium Formula: C24H27N2O2S+ MolecularWeight: 407.54838

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H26N2O2S/c27-29(28,23-12-11-19-6-3-8-21(19)17-23)26-15-13-25(14-16-26)18-22-9-4-7-20-5-1-2-10-24(20)22/h1-2,4-5,7,9-12,17H,3,6,8,13-16,18H2/p+1