3-(3-methyl-4-nitro-phenoxy)-N-propyl-propan-1-amine

Systemtic Name: 3-(3-methyl-4-nitro-phenoxy)-N-propyl-propan-1-amine Openeye Name: 3-(3-methyl-4-nitro-phenoxy)-N-propyl-propan-1-amine CAS Name: 3-(3-methyl-4-nitrophenoxy)-N-propyl-1-propanamine IUPAC Name: 3-(3-methyl-4-nitrophenoxy)-N-propylpropan-1-amine Traditional Name: 3-(3-methyl-4-nitro-phenoxy)propyl-propyl-amine Formula: C13H20N2O3 MolecularWeight: 252.3095

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CCCNCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C13H20N2O3/c1-3-7-14-8-4-9-18-12-5-6-13(15(16)17)11(2)10-12/h5-6,10,14H,3-4,7-9H2,1-2H3