2-[[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoic acid hydrate

Systemtic Name: 2-[[4-ethyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoic acid hydrate Openeye Name: 2-[(4-ethyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-phenyl-acetic acid hydrate CAS Name: 2-[[(4-ethyl-2,3-dioxo-1-piperazinyl)-oxomethyl]amino]-2-phenylacetic acid hydrate IUPAC Name: 2-[(4-ethyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetic acid hydrate Traditional Name: 2-[(4-ethyl-2,3-diketo-piperazine-1-carbonyl)amino]-2-phenyl-acetic acid hydrate Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)O.O

Isomeric SMILES

CCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)O.O

InChI

InChI=1S/C15H17N3O5.H2O/c1-2-17-8-9-18(13(20)12(17)19)15(23)16-11(14(21)22)10-6-4-3-5-7-10;/h3-7,11H,2,8-9H2,1H3,(H,16,23)(H,21,22);1H2