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

Systemtic Name: heptyl (4R)-6-methyl-2-oxidanylidene-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: heptyl (4R)-4-(3-benzyloxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-methyl-2-oxo-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid heptyl ester IUPAC Name: heptyl (4R)-6-methyl-2-oxo-4-(3-phenylmethoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(3-benzoxyphenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid heptyl ester Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)OCC3=CC=CC=C3)C

Isomeric SMILES

CCCCCCCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC(=CC=C2)OCC3=CC=CC=C3)C

InChI

InChI=1S/C26H32N2O4/c1-3-4-5-6-10-16-31-25(29)23-19(2)27-26(30)28-24(23)21-14-11-15-22(17-21)32-18-20-12-8-7-9-13-20/h7-9,11-15,17,24H,3-6,10,16,18H2,1-2H3,(H2,27,28,30)/t24-/m1/s1