N-(1,3-benzodioxol-4-ylmethyl)-1-[6-(4-methoxyphenoxy)pyridin-3-yl]methanamine hydrochloride

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-1-[6-(4-methoxyphenoxy)pyridin-3-yl]methanamine hydrochloride Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-1-[6-(4-methoxyphenoxy)-3-pyridyl]methanamine hydrochloride CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-1-[6-(4-methoxyphenoxy)-3-pyridinyl]methanamine hydrochloride IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-1-[6-(4-methoxyphenoxy)pyridin-3-yl]methanamine hydrochloride Traditional Name: 1,3-benzodioxol-4-ylmethyl-[[6-(4-methoxyphenoxy)-3-pyridyl]methyl]amine hydrochloride Formula: C21H21ClN2O4 MolecularWeight: 400.85544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=NC=C(C=C2)CNCC3=C4C(=CC=C3)OCO4.Cl

Isomeric SMILES

COC1=CC=C(C=C1)OC2=NC=C(C=C2)CNCC3=C4C(=CC=C3)OCO4.Cl

InChI

InChI=1S/C21H20N2O4.ClH/c1-24-17-6-8-18(9-7-17)27-20-10-5-15(12-23-20)11-22-13-16-3-2-4-19-21(16)26-14-25-19;/h2-10,12,22H,11,13-14H2,1H3;1H