2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-hydroxy-2-(3-pyridinyl)ethyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(2R)-2-hydroxy-2-pyridin-3-ylethyl]azanium Traditional Name: homoveratryl-[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]ammonium Formula: C17H23N2O3+ MolecularWeight: 303.37612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]C[C@@H](C2=CN=CC=C2)O)OC

InChI

InChI=1S/C17H22N2O3/c1-21-16-6-5-13(10-17(16)22-2)7-9-19-12-15(20)14-4-3-8-18-11-14/h3-6,8,10-11,15,19-20H,7,9,12H2,1-2H3/p+1/t15-/m0/s1