N-(3-nitrophenoxy)-N-(4-phenylmethoxyphenoxy)propan-1-amine hydrochloride

Systemtic Name: N-(3-nitrophenoxy)-N-(4-phenylmethoxyphenoxy)propan-1-amine hydrochloride Openeye Name: N-(4-benzyloxyphenoxy)-N-(3-nitrophenoxy)propan-1-amine hydrochloride CAS Name: N-(3-nitrophenoxy)-N-(4-phenylmethoxyphenoxy)-1-propanamine hydrochloride IUPAC Name: N-(3-nitrophenoxy)-N-(4-phenylmethoxyphenoxy)propan-1-amine hydrochloride Traditional Name: (4-benzoxyphenoxy)-(3-nitrophenoxy)-propyl-amine hydrochloride Formula: C22H23ClN2O5 MolecularWeight: 430.88142

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(OC1=CC=C(C=C1)OCC2=CC=CC=C2)OC3=CC=CC(=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CCCN(OC1=CC=C(C=C1)OCC2=CC=CC=C2)OC3=CC=CC(=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C22H22N2O5.ClH/c1-2-15-23(29-22-10-6-9-19(16-22)24(25)26)28-21-13-11-20(12-14-21)27-17-18-7-4-3-5-8-18;/h3-14,16H,2,15,17H2,1H3;1H