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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(3-methylphenyl)methyl-propyl-amino]methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[m-tolylmethyl(propyl)amino]methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(3-methylphenyl)methyl-propylamino]methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[[(3-methylphenyl)methyl-propylamino]methyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-[[(3-methylbenzyl)-propyl-amino]methyl]-N-piperonyl-isoxazole-3-carboxamide Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CC(=C1)C)CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN(CC1=CC=CC(=C1)C)CC2=CC(=NO2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H27N3O4/c1-3-9-27(14-19-6-4-5-17(2)10-19)15-20-12-21(26-31-20)24(28)25-13-18-7-8-22-23(11-18)30-16-29-22/h4-8,10-12H,3,9,13-16H2,1-2H3,(H,25,28)