N-(1,3-benzodioxol-5-yl)-1-[(phenylmethyl)carbamoylamino]cyclohexane-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-[(phenylmethyl)carbamoylamino]cyclohexane-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(benzylcarbamoylamino)cyclohexanecarboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[[oxo-[(phenylmethyl)amino]methyl]amino]-1-cyclohexanecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(benzylcarbamoylamino)cyclohexane-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(benzylcarbamoylamino)cyclohexanecarboxamide Formula: C22H25N3O4 MolecularWeight: 395.4516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)(C(=O)NC2=CC3=C(C=C2)OCO3)NC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4/c26-20(24-17-9-10-18-19(13-17)29-15-28-18)22(11-5-2-6-12-22)25-21(27)23-14-16-7-3-1-4-8-16/h1,3-4,7-10,13H,2,5-6,11-12,14-15H2,(H,24,26)(H2,23,25,27)