3-(2-methyl-3-nitro-phenoxy)-N-propyl-propan-1-amine

Systemtic Name: 3-(2-methyl-3-nitro-phenoxy)-N-propyl-propan-1-amine Openeye Name: 3-(2-methyl-3-nitro-phenoxy)-N-propyl-propan-1-amine CAS Name: 3-(2-methyl-3-nitrophenoxy)-N-propyl-1-propanamine IUPAC Name: 3-(2-methyl-3-nitrophenoxy)-N-propylpropan-1-amine Traditional Name: 3-(2-methyl-3-nitro-phenoxy)propyl-propyl-amine Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCCOC1=CC=CC(=C1C)[N+](=O)[O-]

Isomeric SMILES

CCCNCCCOC1=CC=CC(=C1C)[N+](=O)[O-]

InChI

InChI=1S/C13H20N2O3/c1-3-8-14-9-5-10-18-13-7-4-6-12(11(13)2)15(16)17/h4,6-7,14H,3,5,8-10H2,1-2H3