[(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium

Systemtic Name: [(1S)-1-(4-methyl-2-oxidanyl-phenyl)ethyl]-(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)azanium Openeye Name: [(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]-(3-oxo-3-pyrrolidin-1-yl-propyl)ammonium CAS Name: [(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]-[3-oxo-3-(1-pyrrolidinyl)propyl]ammonium IUPAC Name: [(1S)-1-(2-hydroxy-4-methylphenyl)ethyl]-(3-oxo-3-pyrrolidin-1-ylpropyl)azanium Traditional Name: [(1S)-1-(2-hydroxy-4-methyl-phenyl)ethyl]-(3-keto-3-pyrrolidino-propyl)ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)[NH2+]CCC(=O)N2CCCC2)O

Isomeric SMILES

CC1=CC(=C(C=C1)[C@H](C)[NH2+]CCC(=O)N2CCCC2)O

InChI

InChI=1S/C16H24N2O2/c1-12-5-6-14(15(19)11-12)13(2)17-8-7-16(20)18-9-3-4-10-18/h5-6,11,13,17,19H,3-4,7-10H2,1-2H3/p+1/t13-/m0/s1