(3-methoxy-4-oxidanyl-phenyl)methyl-(3-phenylpropyl)azanium

Systemtic Name: (3-methoxy-4-oxidanyl-phenyl)methyl-(3-phenylpropyl)azanium Openeye Name: (4-hydroxy-3-methoxy-phenyl)methyl-(3-phenylpropyl)ammonium CAS Name: (4-hydroxy-3-methoxyphenyl)methyl-(3-phenylpropyl)ammonium IUPAC Name: (4-hydroxy-3-methoxyphenyl)methyl-(3-phenylpropyl)azanium Traditional Name: 3-phenylpropyl(vanillyl)ammonium Formula: C17H22NO2+ MolecularWeight: 272.36208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CCCC2=CC=CC=C2)O

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CCCC2=CC=CC=C2)O

InChI

InChI=1S/C17H21NO2/c1-20-17-12-15(9-10-16(17)19)13-18-11-5-8-14-6-3-2-4-7-14/h2-4,6-7,9-10,12,18-19H,5,8,11,13H2,1H3/p+1