4-[2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoyl]-1-(3,5-dimethylphenyl)piperazin-2-one

Systemtic Name: 4-[2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]ethanoyl]-1-(3,5-dimethylphenyl)piperazin-2-one Openeye Name: 4-[2-[(2R)-1-cyclopentyl-3-oxo-piperazin-1-ium-2-yl]acetyl]-1-(3,5-dimethylphenyl)piperazin-2-one CAS Name: 4-[2-[(2R)-1-cyclopentyl-3-oxo-2-piperazin-1-iumyl]-1-oxoethyl]-1-(3,5-dimethylphenyl)-2-piperazinone IUPAC Name: 4-[2-[(2R)-1-cyclopentyl-3-oxopiperazin-1-ium-2-yl]acetyl]-1-(3,5-dimethylphenyl)piperazin-2-one Traditional Name: 4-[2-[(2R)-1-cyclopentyl-3-keto-piperazin-1-ium-2-yl]acetyl]-1-(3,5-dimethylphenyl)piperazin-2-one Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CCN(CC2=O)C(=O)CC3C(=O)NCC[NH+]3C4CCCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CCN(CC2=O)C(=O)C[C@@H]3C(=O)NCC[NH+]3C4CCCC4)C

InChI

InChI=1S/C23H32N4O3/c1-16-11-17(2)13-19(12-16)27-10-9-25(15-22(27)29)21(28)14-20-23(30)24-7-8-26(20)18-5-3-4-6-18/h11-13,18,20H,3-10,14-15H2,1-2H3,(H,24,30)/p+1/t20-/m1/s1