(3-oxidanylidene-3-pyrrolidin-1-yl-propyl)-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]azanium

Systemtic Name: (3-oxidanylidene-3-pyrrolidin-1-yl-propyl)-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]azanium Openeye Name: (3-oxo-3-pyrrolidin-1-yl-propyl)-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]ammonium CAS Name: [3-oxo-3-(1-pyrrolidinyl)propyl]-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]ammonium IUPAC Name: (3-oxo-3-pyrrolidin-1-ylpropyl)-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]azanium Traditional Name: (3-keto-3-pyrrolidino-propyl)-[(1S)-1-(2,4,5-trimethylphenyl)ethyl]ammonium Formula: C18H29N2O+ MolecularWeight: 289.43566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C(C)[NH2+]CCC(=O)N2CCCC2)C

Isomeric SMILES

CC1=CC(=C(C=C1C)[C@H](C)[NH2+]CCC(=O)N2CCCC2)C

InChI

InChI=1S/C18H28N2O/c1-13-11-15(3)17(12-14(13)2)16(4)19-8-7-18(21)20-9-5-6-10-20/h11-12,16,19H,5-10H2,1-4H3/p+1/t16-/m0/s1