N-[(3-butoxyphenyl)methyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide

Systemtic Name: N-[(3-butoxyphenyl)methyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide Openeye Name: N-[(3-butoxyphenyl)methyl]-4-(isopropylsulfonylamino)cyclohexanecarboxamide CAS Name: N-[(3-butoxyphenyl)methyl]-4-(propan-2-ylsulfonylamino)-1-cyclohexanecarboxamide IUPAC Name: N-[(3-butoxyphenyl)methyl]-4-(propan-2-ylsulfonylamino)cyclohexane-1-carboxamide Traditional Name: N-(3-butoxybenzyl)-4-(isopropylsulfonylamino)cyclohexanecarboxamide Formula: C21H34N2O4S MolecularWeight: 410.57066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)CNC(=O)C2CCC(CC2)NS(=O)(=O)C(C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)CNC(=O)C2CCC(CC2)NS(=O)(=O)C(C)C

InChI

InChI=1S/C21H34N2O4S/c1-4-5-13-27-20-8-6-7-17(14-20)15-22-21(24)18-9-11-19(12-10-18)23-28(25,26)16(2)3/h6-8,14,16,18-19,23H,4-5,9-13,15H2,1-3H3,(H,22,24)