dimethyl (2R)-2-(4-ethoxycarbonylpiperazin-1-ium-1-yl)butanedioate

Systemtic Name: dimethyl (2R)-2-(4-ethoxycarbonylpiperazin-1-ium-1-yl)butanedioate Openeye Name: dimethyl (2R)-2-(4-ethoxycarbonylpiperazin-1-ium-1-yl)butanedioate CAS Name: (2R)-2-(4-ethoxycarbonyl-1-piperazin-1-iumyl)butanedioic acid dimethyl ester IUPAC Name: dimethyl (2R)-2-(4-ethoxycarbonylpiperazin-1-ium-1-yl)butanedioate Traditional Name: (2R)-2-(4-carbethoxypiperazin-1-ium-1-yl)succinic acid dimethyl ester Formula: C13H23N2O6+ MolecularWeight: 303.33152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC[NH+](CC1)C(CC(=O)OC)C(=O)OC

Isomeric SMILES

CCOC(=O)N1CC[NH+](CC1)[C@H](CC(=O)OC)C(=O)OC

InChI

InChI=1S/C13H22N2O6/c1-4-21-13(18)15-7-5-14(6-8-15)10(12(17)20-3)9-11(16)19-2/h10H,4-9H2,1-3H3/p+1/t10-/m1/s1