[4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [4-[(6-chloranylpyridin-3-yl)methoxy]-3-methoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: [4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: [4-[(6-chloro-3-pyridinyl)methoxy]-3-methoxyphenyl]methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [4-[(6-chloropyridin-3-yl)methoxy]-3-methoxyphenyl]methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: [4-[(6-chloro-3-pyridyl)methoxy]-3-methoxy-benzyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C20H24ClN4O2+ MolecularWeight: 387.88316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CCCN2C=CN=C2)OCC3=CN=C(C=C3)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CCCN2C=CN=C2)OCC3=CN=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN4O2/c1-26-19-11-16(12-22-7-2-9-25-10-8-23-15-25)3-5-18(19)27-14-17-4-6-20(21)24-13-17/h3-6,8,10-11,13,15,22H,2,7,9,12,14H2,1H3/p+1