butyl-ethyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-pyridin-3-yl-ethyl]azanium

Systemtic Name: butyl-ethyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-pyridin-3-yl-ethyl]azanium Openeye Name: butyl-ethyl-[(1S)-2-oxo-2-piperazin-1-yl-1-(3-pyridyl)ethyl]ammonium CAS Name: butyl-ethyl-[(1S)-2-oxo-2-(1-piperazinyl)-1-(3-pyridinyl)ethyl]ammonium IUPAC Name: butyl-ethyl-[(1S)-2-oxo-2-piperazin-1-yl-1-pyridin-3-ylethyl]azanium Traditional Name: butyl-ethyl-[(1S)-2-keto-2-piperazino-1-(3-pyridyl)ethyl]ammonium Formula: C17H29N4O+ MolecularWeight: 305.43836

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C(C1=CN=CC=C1)C(=O)N2CCNCC2

Isomeric SMILES

CCCC[NH+](CC)[C@@H](C1=CN=CC=C1)C(=O)N2CCNCC2

InChI

InChI=1S/C17H28N4O/c1-3-5-11-20(4-2)16(15-7-6-8-19-14-15)17(22)21-12-9-18-10-13-21/h6-8,14,16,18H,3-5,9-13H2,1-2H3/p+1/t16-/m0/s1