cyclooctyl (4R)-6-methyl-2-oxidanylidene-4-(2-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: cyclooctyl (4R)-6-methyl-2-oxidanylidene-4-(2-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: cyclooctyl (4R)-4-(2-benzyloxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-methyl-2-oxo-4-(2-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclooctyl ester IUPAC Name: cyclooctyl (4R)-6-methyl-2-oxo-4-(2-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(2-benzoxyphenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid cyclooctyl ester Formula: C27H32N2O4 MolecularWeight: 448.55398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OC4CCCCCCC4

Isomeric SMILES

CC1=C([C@H](NC(=O)N1)C2=CC=CC=C2OCC3=CC=CC=C3)C(=O)OC4CCCCCCC4

InChI

InChI=1S/C27H32N2O4/c1-19-24(26(30)33-21-14-8-3-2-4-9-15-21)25(29-27(31)28-19)22-16-10-11-17-23(22)32-18-20-12-6-5-7-13-20/h5-7,10-13,16-17,21,25H,2-4,8-9,14-15,18H2,1H3,(H2,28,29,31)/t25-/m1/s1