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

Systemtic Name: heptyl (4R)-4-(2-ethoxyphenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: heptyl (4R)-4-(2-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(2-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid heptyl ester IUPAC Name: heptyl (4R)-4-(2-ethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-2-keto-6-methyl-4-o-phenetyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid heptyl ester Formula: C21H30N2O4 MolecularWeight: 374.4739

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2OCC)C

Isomeric SMILES

CCCCCCCOC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=CC=C2OCC)C

InChI

InChI=1S/C21H30N2O4/c1-4-6-7-8-11-14-27-20(24)18-15(3)22-21(25)23-19(18)16-12-9-10-13-17(16)26-5-2/h9-10,12-13,19H,4-8,11,14H2,1-3H3,(H2,22,23,25)/t19-/m1/s1