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

Systemtic Name: 2-[[4-butyl-2,3-bis(oxidanylidene)piperazin-1-yl]carbonylamino]-2-phenyl-ethanoic acid Openeye Name: 2-[(4-butyl-2,3-dioxo-piperazine-1-carbonyl)amino]-2-phenyl-acetic acid CAS Name: 2-[[(4-butyl-2,3-dioxo-1-piperazinyl)-oxomethyl]amino]-2-phenylacetic acid IUPAC Name: 2-[(4-butyl-2,3-dioxopiperazine-1-carbonyl)amino]-2-phenylacetic acid Traditional Name: 2-[(4-butyl-2,3-diketo-piperazine-1-carbonyl)amino]-2-phenyl-acetic acid Formula: C17H21N3O5 MolecularWeight: 347.36574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCN1CCN(C(=O)C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C17H21N3O5/c1-2-3-9-19-10-11-20(15(22)14(19)21)17(25)18-13(16(23)24)12-7-5-4-6-8-12/h4-8,13H,2-3,9-11H2,1H3,(H,18,25)(H,23,24)