butyl-ethyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]azanium

Systemtic Name: butyl-ethyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]azanium Openeye Name: butyl-ethyl-[(1S)-2-oxo-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]ammonium CAS Name: butyl-ethyl-[(1S)-2-oxo-2-(1-piperazinyl)-1-(1H-pyrrol-2-yl)ethyl]ammonium IUPAC Name: butyl-ethyl-[(1S)-2-oxo-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]azanium Traditional Name: butyl-ethyl-[(1S)-2-keto-2-piperazino-1-(1H-pyrrol-2-yl)ethyl]ammonium Formula: C16H29N4O+ MolecularWeight: 293.42766

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)C(C1=CC=CN1)C(=O)N2CCNCC2

Isomeric SMILES

CCCC[NH+](CC)[C@@H](C1=CC=CN1)C(=O)N2CCNCC2

InChI

InChI=1S/C16H28N4O/c1-3-5-11-19(4-2)15(14-7-6-8-18-14)16(21)20-12-9-17-10-13-20/h6-8,15,17-18H,3-5,9-13H2,1-2H3/p+1/t15-/m0/s1