N-(1,3-benzodioxol-5-ylmethyl)-5-[(butan-2-ylamino)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(butan-2-ylamino)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(sec-butylamino)methyl]isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(butan-2-ylamino)methyl]-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-[(butan-2-ylamino)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-piperonyl-5-[(sec-butylamino)methyl]isoxazole-3-carboxamide Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(C)NCC1=CC(=NO1)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H21N3O4/c1-3-11(2)18-9-13-7-14(20-24-13)17(21)19-8-12-4-5-15-16(6-12)23-10-22-15/h4-7,11,18H,3,8-10H2,1-2H3,(H,19,21)