N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)sulfonylamino]cyclohexane-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)sulfonylamino]cyclohexane-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)sulfonylamino]cyclohexanecarboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)sulfonylamino]-1-cyclohexanecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)sulfonylamino]cyclohexane-1-carboxamide Traditional Name: 1-[(4-chlorophenyl)sulfonylamino]-N-piperonyl-cyclohexanecarboxamide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC2=CC3=C(C=C2)OCO3)NS(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H23ClN2O5S/c22-16-5-7-17(8-6-16)30(26,27)24-21(10-2-1-3-11-21)20(25)23-13-15-4-9-18-19(12-15)29-14-28-18/h4-9,12,24H,1-3,10-11,13-14H2,(H,23,25)