2-[[6-methyl-5-oxidanyl-2-[(1-phenylpiperidin-4-yl)methyl]pyrimidin-4-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[6-methyl-5-oxidanyl-2-[(1-phenylpiperidin-4-yl)methyl]pyrimidin-4-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-hydroxy-6-methyl-2-[(1-phenyl-4-piperidyl)methyl]pyrimidine-4-carbonyl]amino]acetic acid CAS Name: 2-[[[5-hydroxy-6-methyl-2-[(1-phenyl-4-piperidinyl)methyl]-4-pyrimidinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[5-hydroxy-6-methyl-2-[(1-phenylpiperidin-4-yl)methyl]pyrimidine-4-carbonyl]amino]acetic acid Traditional Name: 2-[[5-hydroxy-6-methyl-2-[(1-phenyl-4-piperidyl)methyl]pyrimidine-4-carbonyl]amino]acetic acid Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1O)C(=O)NCC(=O)O)CC2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1O)C(=O)NCC(=O)O)CC2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4O4/c1-13-19(27)18(20(28)21-12-17(25)26)23-16(22-13)11-14-7-9-24(10-8-14)15-5-3-2-4-6-15/h2-6,14,27H,7-12H2,1H3,(H,21,28)(H,25,26)