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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylphenyl)carbonyl-pentan-3-yl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylbenzoyl)-(1-ethylpropyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[[(4-tert-butylphenyl)-oxomethyl]-pentan-3-ylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-tert-butylbenzoyl)-pentan-3-ylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(4-tert-butylbenzoyl)-(1-ethylpropyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C29H35N3O5 MolecularWeight: 505.6053

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)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(CC)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/C29H35N3O5/c1-6-22(7-2)32(28(34)20-9-11-21(12-10-20)29(3,4)5)17-23-15-24(31-37-23)27(33)30-16-19-8-13-25-26(14-19)36-18-35-25/h8-15,22H,6-7,16-18H2,1-5H3,(H,30,33)