1-cyclopentyl-4-[2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoyl]piperazin-2-one

Systemtic Name: 1-cyclopentyl-4-[2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoyl]piperazin-2-one Openeye Name: 1-cyclopentyl-4-[2-[(2R)-3-oxo-1-(p-tolylmethyl)piperazin-1-ium-2-yl]acetyl]piperazin-2-one CAS Name: 1-cyclopentyl-4-[2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-1-oxoethyl]-2-piperazinone IUPAC Name: 1-cyclopentyl-4-[2-[(2R)-1-[(4-methylphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]acetyl]piperazin-2-one Traditional Name: 1-cyclopentyl-4-[2-[(2R)-3-keto-1-(4-methylbenzyl)piperazin-1-ium-2-yl]acetyl]piperazin-2-one Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCNC(=O)C2CC(=O)N3CCN(C(=O)C3)C4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCN(C(=O)C3)C4CCCC4

InChI

InChI=1S/C23H32N4O3/c1-17-6-8-18(9-7-17)15-25-11-10-24-23(30)20(25)14-21(28)26-12-13-27(22(29)16-26)19-4-2-3-5-19/h6-9,19-20H,2-5,10-16H2,1H3,(H,24,30)/p+1/t20-/m1/s1