N-[[4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methyl]octan-1-amine hydrochloride

Systemtic Name: N-[[4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methyl]octan-1-amine hydrochloride Openeye Name: N-[[4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-phenyl]methyl]octan-1-amine hydrochloride CAS Name: N-[[4-[(6-chloro-3-pyridinyl)methoxy]-3-methoxyphenyl]methyl]-1-octanamine hydrochloride IUPAC Name: N-[[4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl]methyl]octan-1-amine hydrochloride Traditional Name: [4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-benzyl]-octyl-amine hydrochloride Formula: C22H32Cl2N2O2 MolecularWeight: 427.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNCC1=CC(=C(C=C1)OCC2=CN=C(C=C2)Cl)OC.Cl

Isomeric SMILES

CCCCCCCCNCC1=CC(=C(C=C1)OCC2=CN=C(C=C2)Cl)OC.Cl

InChI

InChI=1S/C22H31ClN2O2.ClH/c1-3-4-5-6-7-8-13-24-15-18-9-11-20(21(14-18)26-2)27-17-19-10-12-22(23)25-16-19;/h9-12,14,16,24H,3-8,13,15,17H2,1-2H3;1H