N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopentyl-(4-methylphenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopentyl-(4-methylphenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopentyl-(4-methylbenzoyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopentyl-[(4-methylphenyl)-oxomethyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclopentyl-(4-methylbenzoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[cyclopentyl(p-toluoyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C26H27N3O5 MolecularWeight: 461.50968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C5CCCC5

InChI

InChI=1S/C26H27N3O5/c1-17-6-9-19(10-7-17)26(31)29(20-4-2-3-5-20)15-21-13-22(28-34-21)25(30)27-14-18-8-11-23-24(12-18)33-16-32-23/h6-13,20H,2-5,14-16H2,1H3,(H,27,30)