N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)tetralin-6-sulfonamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5,6,7,8-tetrahydronaphthalene-2-sulfonamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)tetralin-6-sulfonamide Formula: C22H29N2O2S+ MolecularWeight: 385.54286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H28N2O2S/c25-27(26,22-11-10-19-8-4-5-9-20(19)16-22)23-21-12-14-24(15-13-21)17-18-6-2-1-3-7-18/h1-3,6-7,10-11,16,21,23H,4-5,8-9,12-15,17H2/p+1