2-[2-[3-[(2,4-dimethoxyphenyl)methylcarbamoyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]ethanoic acid

Systemtic Name: 2-[2-[3-[(2,4-dimethoxyphenyl)methylcarbamoyl]piperazin-1-yl]-2-oxidanylidene-ethoxy]ethanoic acid Openeye Name: 2-[2-[3-[(2,4-dimethoxyphenyl)methylcarbamoyl]piperazin-1-yl]-2-oxo-ethoxy]acetic acid CAS Name: 2-[2-[3-[[(2,4-dimethoxyphenyl)methylamino]-oxomethyl]-1-piperazinyl]-2-oxoethoxy]acetic acid IUPAC Name: 2-[2-[3-[(2,4-dimethoxyphenyl)methylcarbamoyl]piperazin-1-yl]-2-oxoethoxy]acetic acid Traditional Name: 2-[2-[3-[(2,4-dimethoxybenzyl)carbamoyl]piperazino]-2-keto-ethoxy]acetic acid Formula: C18H25N3O7 MolecularWeight: 395.407

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)C2CN(CCN2)C(=O)COCC(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)C2CN(CCN2)C(=O)COCC(=O)O)OC

InChI

InChI=1S/C18H25N3O7/c1-26-13-4-3-12(15(7-13)27-2)8-20-18(25)14-9-21(6-5-19-14)16(22)10-28-11-17(23)24/h3-4,7,14,19H,5-6,8-11H2,1-2H3,(H,20,25)(H,23,24)