[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-pyridin-2-yl-ethyl]-dipropyl-azanium

Systemtic Name: [(1S)-2-oxidanylidene-2-piperazin-1-yl-1-pyridin-2-yl-ethyl]-dipropyl-azanium Openeye Name: [(1S)-2-oxo-2-piperazin-1-yl-1-(2-pyridyl)ethyl]-dipropyl-ammonium CAS Name: [(1S)-2-oxo-2-(1-piperazinyl)-1-(2-pyridinyl)ethyl]-dipropylammonium IUPAC Name: [(1S)-2-oxo-2-piperazin-1-yl-1-pyridin-2-ylethyl]-dipropylazanium Traditional Name: [(1S)-2-keto-2-piperazino-1-(2-pyridyl)ethyl]-dipropyl-ammonium Formula: C17H29N4O+ MolecularWeight: 305.43836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)C(C1=CC=CC=N1)C(=O)N2CCNCC2

Isomeric SMILES

CCC[NH+](CCC)[C@@H](C1=CC=CC=N1)C(=O)N2CCNCC2

InChI

InChI=1S/C17H28N4O/c1-3-11-20(12-4-2)16(15-7-5-6-8-19-15)17(22)21-13-9-18-10-14-21/h5-8,16,18H,3-4,9-14H2,1-2H3/p+1/t16-/m0/s1