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

Systemtic Name: butyl-methyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]azanium Openeye Name: butyl-methyl-[(1S)-2-oxo-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]ammonium CAS Name: butyl-methyl-[(1S)-2-oxo-2-(1-piperazinyl)-1-(1H-pyrrol-2-yl)ethyl]ammonium IUPAC Name: butyl-methyl-[(1S)-2-oxo-2-piperazin-1-yl-1-(1H-pyrrol-2-yl)ethyl]azanium Traditional Name: butyl-[(1S)-2-keto-2-piperazino-1-(1H-pyrrol-2-yl)ethyl]-methyl-ammonium Formula: C15H27N4O+ MolecularWeight: 279.40108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N4O/c1-3-4-10-18(2)14(13-6-5-7-17-13)15(20)19-11-8-16-9-12-19/h5-7,14,16-17H,3-4,8-12H2,1-2H3/p+1/t14-/m0/s1