1-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol

Systemtic Name: 1-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Openeye Name: 1-[(4-tetralin-6-ylsulfonylpiperazin-1-ium-1-yl)methyl]naphthalen-2-ol CAS Name: 1-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazin-1-iumyl]methyl]-2-naphthalenol IUPAC Name: 1-[[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-ium-1-yl]methyl]naphthalen-2-ol Traditional Name: 1-[(4-tetralin-6-ylsulfonylpiperazin-1-ium-1-yl)methyl]-2-naphthol Formula: C25H29N2O3S+ MolecularWeight: 437.57436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=C(C=CC5=CC=CC=C54)O

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CC[NH+](CC3)CC4=C(C=CC5=CC=CC=C54)O

InChI

InChI=1S/C25H28N2O3S/c28-25-12-10-20-6-3-4-8-23(20)24(25)18-26-13-15-27(16-14-26)31(29,30)22-11-9-19-5-1-2-7-21(19)17-22/h3-4,6,8-12,17,28H,1-2,5,7,13-16,18H2/p+1