N-(1,3-benzodioxol-5-ylmethyl)-4-[(quinolin-8-ylsulfonylamino)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(quinolin-8-ylsulfonylamino)methyl]cyclohexane-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(8-quinolylsulfonylamino)methyl]cyclohexanecarboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(8-quinolinylsulfonylamino)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(quinolin-8-ylsulfonylamino)methyl]cyclohexane-1-carboxamide Traditional Name: N-piperonyl-4-[(8-quinolylsulfonylamino)methyl]cyclohexanecarboxamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(CCC1CNS(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H27N3O5S/c29-25(27-14-18-8-11-21-22(13-18)33-16-32-21)20-9-6-17(7-10-20)15-28-34(30,31)23-5-1-3-19-4-2-12-26-24(19)23/h1-5,8,11-13,17,20,28H,6-7,9-10,14-16H2,(H,27,29)