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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(4-tert-butylphenyl)carbonyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylbenzoyl)-sec-butyl-amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-[(4-tert-butylphenyl)-oxomethyl]amino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[butan-2-yl-(4-tert-butylbenzoyl)amino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(4-tert-butylbenzoyl)-sec-butyl-amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C28H33N3O5 MolecularWeight: 491.57872

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCC(C)N(CC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H33N3O5/c1-6-18(2)31(27(33)20-8-10-21(11-9-20)28(3,4)5)16-22-14-23(30-36-22)26(32)29-15-19-7-12-24-25(13-19)35-17-34-24/h7-14,18H,6,15-17H2,1-5H3,(H,29,32)