N-cyclopropyl-2-[4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidin-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidin-4-yl]carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(1-tetralin-6-ylsulfonylpiperidine-4-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[oxo-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4-piperidinyl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carbonyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(1-tetralin-6-ylsulfonylisonipecotoyl)piperazin-1-ium-1-yl]acetamide Formula: C25H37N4O4S+ MolecularWeight: 489.65068

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N4CC[NH+](CC4)CC(=O)NC5CC5

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCC(CC3)C(=O)N4CC[NH+](CC4)CC(=O)NC5CC5

InChI

InChI=1S/C25H36N4O4S/c30-24(26-22-6-7-22)18-27-13-15-28(16-14-27)25(31)20-9-11-29(12-10-20)34(32,33)23-8-5-19-3-1-2-4-21(19)17-23/h5,8,17,20,22H,1-4,6-7,9-16,18H2,(H,26,30)/p+1