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

Systemtic Name: 2-[[2-[[1-(4-tert-butylphenyl)piperidin-4-yl]methyl]-6-methyl-5-oxidanyl-pyrimidin-4-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[2-[[1-(4-tert-butylphenyl)-4-piperidyl]methyl]-5-hydroxy-6-methyl-pyrimidine-4-carbonyl]amino]acetic acid CAS Name: 2-[[[2-[[1-(4-tert-butylphenyl)-4-piperidinyl]methyl]-5-hydroxy-6-methyl-4-pyrimidinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[2-[[1-(4-tert-butylphenyl)piperidin-4-yl]methyl]-5-hydroxy-6-methylpyrimidine-4-carbonyl]amino]acetic acid Traditional Name: 2-[[2-[[1-(4-tert-butylphenyl)-4-piperidyl]methyl]-5-hydroxy-6-methyl-pyrimidine-4-carbonyl]amino]acetic acid Formula: C24H32N4O4 MolecularWeight: 440.53528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N4O4/c1-15-22(31)21(23(32)25-14-20(29)30)27-19(26-15)13-16-9-11-28(12-10-16)18-7-5-17(6-8-18)24(2,3)4/h5-8,16,31H,9-14H2,1-4H3,(H,25,32)(H,29,30)