1-(4-methylphenyl)sulfonyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-piperidine-4-carboxamide

Systemtic Name: 1-(4-methylphenyl)sulfonyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-piperidine-4-carboxamide Openeye Name: 1-(p-tolylsulfonyl)-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-piperidine-4-carboxamide CAS Name: 1-(4-methylphenyl)sulfonyl-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)sulfonyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-ylpiperidine-4-carboxamide Traditional Name: N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-1-tosyl-isonipecotamide Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OC5(O4)CCCCC5

InChI

InChI=1S/C25H30N2O5S/c1-18-5-8-21(9-6-18)33(29,30)27-15-11-19(12-16-27)24(28)26-20-7-10-22-23(17-20)32-25(31-22)13-3-2-4-14-25/h5-10,17,19H,2-4,11-16H2,1H3,(H,26,28)