(3,5-dimethyl-4-oxidanyl-phenyl)methyl-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium

Systemtic Name: (3,5-dimethyl-4-oxidanyl-phenyl)methyl-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium Openeye Name: (4-hydroxy-3,5-dimethyl-phenyl)methyl-(3-oxo-3-pyrrolidin-1-yl-propyl)ammonium CAS Name: (4-hydroxy-3,5-dimethylphenyl)methyl-[3-oxo-3-(1-pyrrolidinyl)propyl]ammonium IUPAC Name: (4-hydroxy-3,5-dimethylphenyl)methyl-(3-oxo-3-pyrrolidin-1-ylpropyl)azanium Traditional Name: (4-hydroxy-3,5-dimethyl-benzyl)-(3-keto-3-pyrrolidino-propyl)ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)C[NH2+]CCC(=O)N2CCCC2

Isomeric SMILES

CC1=CC(=CC(=C1O)C)C[NH2+]CCC(=O)N2CCCC2

InChI

InChI=1S/C16H24N2O2/c1-12-9-14(10-13(2)16(12)20)11-17-6-5-15(19)18-7-3-4-8-18/h9-10,17,20H,3-8,11H2,1-2H3/p+1