N-(1,3-benzodioxol-5-ylmethyl)-1-[(1-cyclobutylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(1-cyclobutylcarbonyl-3,4-dihydro-2H-quinolin-6-yl)sulfonyl]piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[[1-(cyclobutanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]sulfonyl]piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[[1-[cyclobutyl(oxo)methyl]-3,4-dihydro-2H-quinolin-6-yl]sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[[1-(cyclobutanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]sulfonyl]piperidine-4-carboxamide Traditional Name: 1-[[1-(cyclobutanecarbonyl)-3,4-dihydro-2H-quinolin-6-yl]sulfonyl]-N-piperonyl-isonipecotamide Formula: C28H33N3O6S MolecularWeight: 539.64312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCCC3=C2C=CC(=C3)S(=O)(=O)N4CCC(CC4)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CC(C1)C(=O)N2CCCC3=C2C=CC(=C3)S(=O)(=O)N4CCC(CC4)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H33N3O6S/c32-27(29-17-19-6-9-25-26(15-19)37-18-36-25)20-10-13-30(14-11-20)38(34,35)23-7-8-24-22(16-23)5-2-12-31(24)28(33)21-3-1-4-21/h6-9,15-16,20-21H,1-5,10-14,17-18H2,(H,29,32)