(3-ethoxy-4-oxidanyl-phenyl)methyl-(3-oxidanylpropyl)azanium

Systemtic Name: (3-ethoxy-4-oxidanyl-phenyl)methyl-(3-oxidanylpropyl)azanium Openeye Name: (3-ethoxy-4-hydroxy-phenyl)methyl-(3-hydroxypropyl)ammonium CAS Name: (3-ethoxy-4-hydroxyphenyl)methyl-(3-hydroxypropyl)ammonium IUPAC Name: (3-ethoxy-4-hydroxyphenyl)methyl-(3-hydroxypropyl)azanium Traditional Name: (3-ethoxy-4-hydroxy-benzyl)-(3-hydroxypropyl)ammonium Formula: C12H20NO3+ MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCCO)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCCO)O

InChI

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