(3R)-3-[2-(4-cyclopentylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-3-[2-(4-cyclopentylpiperazin-1-yl)-2-oxidanylidene-ethyl]-4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-one Openeye Name: (3R)-3-[2-(4-cyclopentylpiperazin-1-yl)-2-oxo-ethyl]-4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-one CAS Name: (3R)-3-[2-(4-cyclopentyl-1-piperazinyl)-2-oxoethyl]-4-[(4-ethoxyphenyl)methyl]-2-piperazin-4-iumone IUPAC Name: (3R)-3-[2-(4-cyclopentylpiperazin-1-yl)-2-oxoethyl]-4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-2-one Traditional Name: (3R)-3-[2-(4-cyclopentylpiperazino)-2-keto-ethyl]-4-(4-ethoxybenzyl)piperazin-4-ium-2-one Formula: C24H37N4O3+ MolecularWeight: 429.57558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCNC(=O)C2CC(=O)N3CCN(CC3)C4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCN(CC3)C4CCCC4

InChI

InChI=1S/C24H36N4O3/c1-2-31-21-9-7-19(8-10-21)18-28-12-11-25-24(30)22(28)17-23(29)27-15-13-26(14-16-27)20-5-3-4-6-20/h7-10,20,22H,2-6,11-18H2,1H3,(H,25,30)/p+1/t22-/m1/s1