2-azanyl-N-(1,3-benzodioxol-5-yl)-3-methyl-pentanamide

Systemtic Name: 2-azanyl-N-(1,3-benzodioxol-5-yl)-3-methyl-pentanamide Openeye Name: 2-amino-N-(1,3-benzodioxol-5-yl)-3-methyl-pentanamide CAS Name: 2-amino-N-(1,3-benzodioxol-5-yl)-3-methylpentanamide IUPAC Name: 2-amino-N-(1,3-benzodioxol-5-yl)-3-methylpentanamide Traditional Name: 2-amino-N-(1,3-benzodioxol-5-yl)-3-methyl-valeramide Formula: C13H18N2O3 MolecularWeight: 250.29362

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC2=C(C=C1)OCO2)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC2=C(C=C1)OCO2)N

InChI

InChI=1S/C13H18N2O3/c1-3-8(2)12(14)13(16)15-9-4-5-10-11(6-9)18-7-17-10/h4-6,8,12H,3,7,14H2,1-2H3,(H,15,16)