3-imidazol-1-ylpropyl-[(3-methoxy-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(3-methoxy-2-oxidanyl-phenyl)methyl]azanium Openeye Name: (2-hydroxy-3-methoxy-phenyl)methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: (2-hydroxy-3-methoxyphenyl)methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: (2-hydroxy-3-methoxyphenyl)methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: (2-hydroxy-3-methoxy-benzyl)-(3-imidazol-1-ylpropyl)ammonium Formula: C14H20N3O2+ MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)C[NH2+]CCCN2C=CN=C2

Isomeric SMILES

COC1=CC=CC(=C1O)C[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C14H19N3O2/c1-19-13-5-2-4-12(14(13)18)10-15-6-3-8-17-9-7-16-11-17/h2,4-5,7,9,11,15,18H,3,6,8,10H2,1H3/p+1