N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclohexylcarbonyl(1-phenylethyl)amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclohexylcarbonyl(1-phenylethyl)amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclohexanecarbonyl(1-phenylethyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[[cyclohexyl(oxo)methyl]-(1-phenylethyl)amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[cyclohexanecarbonyl(1-phenylethyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[cyclohexanecarbonyl(1-phenylethyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5CCCCC5

Isomeric SMILES

CC(C1=CC=CC=C1)N(CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5CCCCC5

InChI

InChI=1S/C28H31N3O5/c1-19(21-8-4-2-5-9-21)31(28(33)22-10-6-3-7-11-22)17-23-15-24(30-36-23)27(32)29-16-20-12-13-25-26(14-20)35-18-34-25/h2,4-5,8-9,12-15,19,22H,3,6-7,10-11,16-18H2,1H3,(H,29,32)