[2-[(4-oxidanylpiperidin-1-yl)carbonylamino]-3H-benzimidazol-5-yl] 4-(4-oxidanylpiperidin-1-yl)benzenesulfonate

Systemtic Name: [2-[(4-oxidanylpiperidin-1-yl)carbonylamino]-3H-benzimidazol-5-yl] 4-(4-oxidanylpiperidin-1-yl)benzenesulfonate Openeye Name: [2-[(4-hydroxypiperidine-1-carbonyl)amino]-3H-benzimidazol-5-yl] 4-(4-hydroxy-1-piperidyl)benzenesulfonate CAS Name: 4-(4-hydroxy-1-piperidinyl)benzenesulfonic acid [2-[[(4-hydroxy-1-piperidinyl)-oxomethyl]amino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-[(4-hydroxypiperidine-1-carbonyl)amino]-3H-benzimidazol-5-yl] 4-(4-hydroxypiperidin-1-yl)benzenesulfonate Traditional Name: 4-(4-hydroxypiperidino)benzenesulfonic acid [2-[(4-hydroxypiperidine-1-carbonyl)amino]-3H-benzimidazol-5-yl] ester Formula: C24H29N5O6S MolecularWeight: 515.58196

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)N5CCC(CC5)O

Isomeric SMILES

C1CN(CCC1O)C2=CC=C(C=C2)S(=O)(=O)OC3=CC4=C(C=C3)N=C(N4)NC(=O)N5CCC(CC5)O

InChI

InChI=1S/C24H29N5O6S/c30-17-7-11-28(12-8-17)16-1-4-20(5-2-16)36(33,34)35-19-3-6-21-22(15-19)26-23(25-21)27-24(32)29-13-9-18(31)10-14-29/h1-6,15,17-18,30-31H,7-14H2,(H2,25,26,27,32)