1-(6-nitro-1,3-benzodioxol-5-yl)propan-2-amine

Systemtic Name: 1-(6-nitro-1,3-benzodioxol-5-yl)propan-2-amine Openeye Name: 1-(6-nitro-1,3-benzodioxol-5-yl)propan-2-amine CAS Name: 1-(6-nitro-1,3-benzodioxol-5-yl)-2-propanamine IUPAC Name: 1-(6-nitro-1,3-benzodioxol-5-yl)propan-2-amine Traditional Name: [1-methyl-2-(6-nitro-1,3-benzodioxol-5-yl)ethyl]amine Formula: C10H12N2O4 MolecularWeight: 224.21328

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1[N+](=O)[O-])OCO2)N

Isomeric SMILES

CC(CC1=CC2=C(C=C1[N+](=O)[O-])OCO2)N

InChI

InChI=1S/C10H12N2O4/c1-6(11)2-7-3-9-10(16-5-15-9)4-8(7)12(13)14/h3-4,6H,2,5,11H2,1H3