N-(1,3-benzodioxol-5-ylmethyl)-8-hexanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-8-hexanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-8-hexanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-8-(1-oxohexyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-8-hexanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-caproyl-N-piperonyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C22H31N3O4S MolecularWeight: 433.56424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H31N3O4S/c1-2-3-4-5-20(26)25-10-8-22(9-11-25)24-17(14-30-22)21(27)23-13-16-6-7-18-19(12-16)29-15-28-18/h6-7,12,17,24H,2-5,8-11,13-15H2,1H3,(H,23,27)