(3,5-dimethoxyphenyl)methyl-(3-oxidanylpropyl)azanium

Systemtic Name: (3,5-dimethoxyphenyl)methyl-(3-oxidanylpropyl)azanium Openeye Name: (3,5-dimethoxyphenyl)methyl-(3-hydroxypropyl)ammonium CAS Name: (3,5-dimethoxyphenyl)methyl-(3-hydroxypropyl)ammonium IUPAC Name: (3,5-dimethoxyphenyl)methyl-(3-hydroxypropyl)azanium Traditional Name: (3,5-dimethoxybenzyl)-(3-hydroxypropyl)ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C[NH2+]CCCO)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C[NH2+]CCCO)OC

InChI

InChI=1S/C12H19NO3/c1-15-11-6-10(7-12(8-11)16-2)9-13-4-3-5-14/h6-8,13-14H,3-5,9H2,1-2H3/p+1