(3R)-3-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-(3-methylbutyl)piperazin-4-ium-2-one

Systemtic Name: (3R)-3-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-(3-methylbutyl)piperazin-4-ium-2-one Openeye Name: (3R)-3-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]-4-isopentyl-piperazin-4-ium-2-one CAS Name: (3R)-3-[2-(4-acetyl-1-piperazinyl)-2-oxoethyl]-4-(3-methylbutyl)-2-piperazin-4-iumone IUPAC Name: (3R)-3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-(3-methylbutyl)piperazin-4-ium-2-one Traditional Name: (3R)-3-[2-(4-acetylpiperazino)-2-keto-ethyl]-4-isoamyl-piperazin-4-ium-2-one Formula: C17H31N4O3+ MolecularWeight: 339.45304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+]1CCNC(=O)C1CC(=O)N2CCN(CC2)C(=O)C

Isomeric SMILES

CC(C)CC[NH+]1CCNC(=O)[C@H]1CC(=O)N2CCN(CC2)C(=O)C

InChI

InChI=1S/C17H30N4O3/c1-13(2)4-6-20-7-5-18-17(24)15(20)12-16(23)21-10-8-19(9-11-21)14(3)22/h13,15H,4-12H2,1-3H3,(H,18,24)/p+1/t15-/m1/s1