(3,4-dimethoxyphenyl)methyl-[2-oxidanyl-3-(2-oxidanylidenepyrrolidin-1-yl)propyl]azanium chloride

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[2-oxidanyl-3-(2-oxidanylidenepyrrolidin-1-yl)propyl]azanium chloride Openeye Name: (3,4-dimethoxyphenyl)methyl-[2-hydroxy-3-(2-oxopyrrolidin-1-yl)propyl]ammonium chloride CAS Name: (3,4-dimethoxyphenyl)methyl-[2-hydroxy-3-(2-oxo-1-pyrrolidinyl)propyl]ammonium chloride IUPAC Name: (3,4-dimethoxyphenyl)methyl-[2-hydroxy-3-(2-oxopyrrolidin-1-yl)propyl]azanium chloride Traditional Name: [2-hydroxy-3-(2-ketopyrrolidino)propyl]-veratryl-ammonium chloride Formula: C16H25ClN2O4 MolecularWeight: 344.8337

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CC(CN2CCCC2=O)O)OC.[Cl-]

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CC(CN2CCCC2=O)O)OC.[Cl-]

InChI

InChI=1S/C16H24N2O4.ClH/c1-21-14-6-5-12(8-15(14)22-2)9-17-10-13(19)11-18-7-3-4-16(18)20;/h5-6,8,13,17,19H,3-4,7,9-11H2,1-2H3;1H