4-[4-[3-(1-adamantylcarbonylamino)propoxy]phenyl]sulfonyl-1-cyclopropyl-N-oxidanyl-piperidine-4-carboxamide hydrochloride

Systemtic Name: 4-[4-[3-(1-adamantylcarbonylamino)propoxy]phenyl]sulfonyl-1-cyclopropyl-N-oxidanyl-piperidine-4-carboxamide hydrochloride Openeye Name: N-[3-[4-[[1-cyclopropyl-4-(hydroxycarbamoyl)-4-piperidyl]sulfonyl]phenoxy]propyl]adamantane-1-carboxamide hydrochloride CAS Name: 4-[4-[3-[[1-adamantyl(oxo)methyl]amino]propoxy]phenyl]sulfonyl-1-cyclopropyl-N-hydroxy-4-piperidinecarboxamide hydrochloride IUPAC Name: 4-[4-[3-(adamantane-1-carbonylamino)propoxy]phenyl]sulfonyl-1-cyclopropyl-N-hydroxypiperidine-4-carboxamide hydrochloride Traditional Name: N-[3-[4-[[1-cyclopropyl-4-(hydroxycarbamoyl)-4-piperidyl]sulfonyl]phenoxy]propyl]adamantane-1-carboxamide hydrochloride Formula: C29H42ClN3O6S MolecularWeight: 596.17828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2CCC(CC2)(C(=O)NO)S(=O)(=O)C3=CC=C(C=C3)OCCCNC(=O)C45CC6CC(C4)CC(C6)C5.Cl

Isomeric SMILES

C1CC1N2CCC(CC2)(C(=O)NO)S(=O)(=O)C3=CC=C(C=C3)OCCCNC(=O)C45CC6CC(C4)CC(C6)C5.Cl

InChI

InChI=1S/C29H41N3O6S.ClH/c33-26(28-17-20-14-21(18-28)16-22(15-20)19-28)30-10-1-13-38-24-4-6-25(7-5-24)39(36,37)29(27(34)31-35)8-11-32(12-9-29)23-2-3-23;/h4-7,20-23,35H,1-3,8-19H2,(H,30,33)(H,31,34);1H