2-azanyl-3-ethyl-2-(phenylcarbonyl)-3-pyrimidin-5-yl-pentanedioic acid

Systemtic Name: 2-azanyl-3-ethyl-2-(phenylcarbonyl)-3-pyrimidin-5-yl-pentanedioic acid Openeye Name: 2-amino-2-benzoyl-3-ethyl-3-pyrimidin-5-yl-pentanedioic acid CAS Name: 2-amino-2-benzoyl-3-ethyl-3-(5-pyrimidinyl)pentanedioic acid IUPAC Name: 2-amino-2-benzoyl-3-ethyl-3-pyrimidin-5-ylpentanedioic acid Traditional Name: 2-amino-2-benzoyl-3-ethyl-3-(5-pyrimidyl)glutaric acid Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)O)(C1=CN=CN=C1)C(C(=O)C2=CC=CC=C2)(C(=O)O)N

Isomeric SMILES

CCC(CC(=O)O)(C1=CN=CN=C1)C(C(=O)C2=CC=CC=C2)(C(=O)O)N

InChI

InChI=1S/C18H19N3O5/c1-2-17(8-14(22)23,13-9-20-11-21-10-13)18(19,16(25)26)15(24)12-6-4-3-5-7-12/h3-7,9-11H,2,8,19H2,1H3,(H,22,23)(H,25,26)