N-[3-(1,3-benzodioxol-5-yl)propyl]-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-yl)propyl]-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-yl)propyl]-4-(tert-butylsulfonylamino)cyclohexanecarboxamide CAS Name: N-[3-(1,3-benzodioxol-5-yl)propyl]-4-(tert-butylsulfonylamino)-1-cyclohexanecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-yl)propyl]-4-(tert-butylsulfonylamino)cyclohexane-1-carboxamide Traditional Name: N-[3-(1,3-benzodioxol-5-yl)propyl]-4-(tert-butylsulfonylamino)cyclohexanecarboxamide Formula: C21H32N2O5S MolecularWeight: 424.55418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NCCCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)S(=O)(=O)NC1CCC(CC1)C(=O)NCCCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H32N2O5S/c1-21(2,3)29(25,26)23-17-9-7-16(8-10-17)20(24)22-12-4-5-15-6-11-18-19(13-15)28-14-27-18/h6,11,13,16-17,23H,4-5,7-10,12,14H2,1-3H3,(H,22,24)