(5-methoxy-2-oxidanyl-phenyl)methyl-(3-methoxypropyl)azanium

Systemtic Name: (5-methoxy-2-oxidanyl-phenyl)methyl-(3-methoxypropyl)azanium Openeye Name: (2-hydroxy-5-methoxy-phenyl)methyl-(3-methoxypropyl)ammonium CAS Name: (2-hydroxy-5-methoxyphenyl)methyl-(3-methoxypropyl)ammonium IUPAC Name: (2-hydroxy-5-methoxyphenyl)methyl-(3-methoxypropyl)azanium Traditional Name: (2-hydroxy-5-methoxy-benzyl)-(3-methoxypropyl)ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

COCCC[NH2+]CC1=C(C=CC(=C1)OC)O

Isomeric SMILES

COCCC[NH2+]CC1=C(C=CC(=C1)OC)O

InChI

InChI=1S/C12H19NO3/c1-15-7-3-6-13-9-10-8-11(16-2)4-5-12(10)14/h4-5,8,13-14H,3,6-7,9H2,1-2H3/p+1