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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-methoxyphenyl)methyl-pentan-3-yl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[1-ethylpropyl-[(4-methoxyphenyl)methyl]amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-methoxyphenyl)methyl-pentan-3-ylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(4-methoxyphenyl)methyl-pentan-3-ylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[1-ethylpropyl(p-anisyl)amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3O5/c1-4-20(5-2)29(15-18-6-9-21(31-3)10-7-18)16-22-13-23(28-34-22)26(30)27-14-19-8-11-24-25(12-19)33-17-32-24/h6-13,20H,4-5,14-17H2,1-3H3,(H,27,30)