[4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methyl-(pyridin-4-ylmethyl)azanium

Systemtic Name: [4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methyl-(pyridin-4-ylmethyl)azanium Openeye Name: [4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-phenyl]methyl-(4-pyridylmethyl)ammonium CAS Name: [4-[(6-chloro-3-pyridinyl)methoxy]-3-methoxyphenyl]methyl-(pyridin-4-ylmethyl)ammonium IUPAC Name: [4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl]methyl-(pyridin-4-ylmethyl)azanium Traditional Name: [4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-benzyl]-(4-pyridylmethyl)ammonium Formula: C20H21ClN3O2+ MolecularWeight: 370.85264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=NC=C2)OCC3=CN=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC2=CC=NC=C2)OCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2/c1-25-19-10-16(12-23-11-15-6-8-22-9-7-15)2-4-18(19)26-14-17-3-5-20(21)24-13-17/h2-10,13,23H,11-12,14H2,1H3/p+1