2-[(2-cyclohexyl-6-oxidanyl-4-oxidanylidene-1-phenyl-pyrimidin-5-yl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(2-cyclohexyl-6-oxidanyl-4-oxidanylidene-1-phenyl-pyrimidin-5-yl)carbonylamino]ethanoic acid Openeye Name: 2-[(2-cyclohexyl-6-hydroxy-4-oxo-1-phenyl-pyrimidine-5-carbonyl)amino]acetic acid CAS Name: 2-[[(2-cyclohexyl-6-hydroxy-4-oxo-1-phenyl-5-pyrimidinyl)-oxomethyl]amino]acetic acid IUPAC Name: 2-[(2-cyclohexyl-6-hydroxy-4-oxo-1-phenylpyrimidine-5-carbonyl)amino]acetic acid Traditional Name: 2-[(2-cyclohexyl-6-hydroxy-4-keto-1-phenyl-pyrimidine-5-carbonyl)amino]acetic acid Formula: C19H21N3O5 MolecularWeight: 371.38714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=O)C(=C(N2C3=CC=CC=C3)O)C(=O)NCC(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NC(=O)C(=C(N2C3=CC=CC=C3)O)C(=O)NCC(=O)O

InChI

InChI=1S/C19H21N3O5/c23-14(24)11-20-17(25)15-18(26)21-16(12-7-3-1-4-8-12)22(19(15)27)13-9-5-2-6-10-13/h2,5-6,9-10,12,27H,1,3-4,7-8,11H2,(H,20,25)(H,23,24)