N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylphenyl)carbonyl-cyclohexyl-amino]methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylphenyl)carbonyl-cyclohexyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylbenzoyl)-cyclohexyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[[(4-tert-butylphenyl)-oxomethyl]-cyclohexylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylbenzoyl)-cyclohexylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(4-tert-butylbenzoyl)-cyclohexyl-amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C30H35N3O5 MolecularWeight: 517.616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H35N3O5/c1-30(2,3)22-12-10-21(11-13-22)29(35)33(23-7-5-4-6-8-23)18-24-16-25(32-38-24)28(34)31-17-20-9-14-26-27(15-20)37-19-36-26/h9-16,23H,4-8,17-19H2,1-3H3,(H,31,34)