(2,4-dimethylphenyl)-[(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (2,4-dimethylphenyl)-[(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (2,4-dimethylphenyl)-[(1S)-2-[(2S)-2-ethyl-1-piperidyl]-1-methyl-2-oxo-ethyl]ammonium CAS Name: (2,4-dimethylphenyl)-[(2S)-1-[(2S)-2-ethyl-1-piperidinyl]-1-oxopropan-2-yl]ammonium IUPAC Name: (2,4-dimethylphenyl)-[(2S)-1-[(2S)-2-ethylpiperidin-1-yl]-1-oxopropan-2-yl]azanium Traditional Name: (2,4-dimethylphenyl)-[(1S)-2-[(2S)-2-ethylpiperidino]-2-keto-1-methyl-ethyl]ammonium Formula: C18H29N2O+ MolecularWeight: 289.43566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)[NH2+]C2=C(C=C(C=C2)C)C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)[C@H](C)[NH2+]C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C18H28N2O/c1-5-16-8-6-7-11-20(16)18(21)15(4)19-17-10-9-13(2)12-14(17)3/h9-10,12,15-16,19H,5-8,11H2,1-4H3/p+1/t15-,16-/m0/s1