2-azanyl-3-methyl-N-(6-nitro-1,3-benzodioxol-5-yl)pentanamide

Systemtic Name: 2-azanyl-3-methyl-N-(6-nitro-1,3-benzodioxol-5-yl)pentanamide Openeye Name: 2-amino-3-methyl-N-(6-nitro-1,3-benzodioxol-5-yl)pentanamide CAS Name: 2-amino-3-methyl-N-(6-nitro-1,3-benzodioxol-5-yl)pentanamide IUPAC Name: 2-amino-3-methyl-N-(6-nitro-1,3-benzodioxol-5-yl)pentanamide Traditional Name: 2-amino-3-methyl-N-(6-nitro-1,3-benzodioxol-5-yl)valeramide Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=CC2=C(C=C1[N+](=O)[O-])OCO2)N

Isomeric SMILES

CCC(C)C(C(=O)NC1=CC2=C(C=C1[N+](=O)[O-])OCO2)N

InChI

InChI=1S/C13H17N3O5/c1-3-7(2)12(14)13(17)15-8-4-10-11(21-6-20-10)5-9(8)16(18)19/h4-5,7,12H,3,6,14H2,1-2H3,(H,15,17)