[(2R,3S)-3-methylpentan-2-yl]-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium

Systemtic Name: [(2R,3S)-3-methylpentan-2-yl]-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium Openeye Name: [(1R,2S)-1,2-dimethylbutyl]-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]ammonium CAS Name: [(2R,3S)-3-methylpentan-2-yl]-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: [(2R,3S)-3-methylpentan-2-yl]-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]azanium Traditional Name: [(1R,2S)-1,2-dimethylbutyl]-[4-(2-ketopyrrolidino)benzyl]ammonium Formula: C17H27N2O+ MolecularWeight: 275.40908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O/c1-4-13(2)14(3)18-12-15-7-9-16(10-8-15)19-11-5-6-17(19)20/h7-10,13-14,18H,4-6,11-12H2,1-3H3/p+1/t13-,14+/m0/s1