N-[1-(4-nitro-3-phenylmethoxy-phenyl)ethyl]-N-propyl-propan-1-amine

Systemtic Name: N-[1-(4-nitro-3-phenylmethoxy-phenyl)ethyl]-N-propyl-propan-1-amine Openeye Name: N-[1-(3-benzyloxy-4-nitro-phenyl)ethyl]-N-propyl-propan-1-amine CAS Name: N-[1-(4-nitro-3-phenylmethoxyphenyl)ethyl]-N-propyl-1-propanamine IUPAC Name: N-[1-(4-nitro-3-phenylmethoxyphenyl)ethyl]-N-propylpropan-1-amine Traditional Name: 1-(3-benzoxy-4-nitro-phenyl)ethyl-dipropyl-amine Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(C)C1=CC(=C(C=C1)[N+](=O)[O-])OCC2=CC=CC=C2

Isomeric SMILES

CCCN(CCC)C(C)C1=CC(=C(C=C1)[N+](=O)[O-])OCC2=CC=CC=C2

InChI

InChI=1S/C21H28N2O3/c1-4-13-22(14-5-2)17(3)19-11-12-20(23(24)25)21(15-19)26-16-18-9-7-6-8-10-18/h6-12,15,17H,4-5,13-14,16H2,1-3H3