2-[[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-phenyl-amino]ethanoic acid

Systemtic Name: 2-[[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-phenyl-amino]ethanoic acid Openeye Name: 2-(N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]anilino)acetic acid CAS Name: 2-(N-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]anilino)acetic acid IUPAC Name: 2-(N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]anilino)acetic acid Traditional Name: 2-(N-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl]anilino)acetic acid Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN(CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN(CC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5O3/c24-16(13-23(14-17(25)26)15-5-2-1-3-6-15)21-9-11-22(12-10-21)18-19-7-4-8-20-18/h1-8H,9-14H2,(H,25,26)