methyl (4S,5R)-4-(2,4-dimethylphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl (4S,5R)-4-(2,4-dimethylphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl (4S,5R)-4-(2,4-dimethylphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(2,4-dimethylphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-4-(2,4-dimethylphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(2,4-dimethylphenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC)C

InChI

InChI=1S/C15H18N2O3/c1-8-5-6-11(9(2)7-8)13-12(14(18)20-4)10(3)16-15(19)17-13/h5-7,12-13H,3H2,1-2,4H3,(H2,16,17,19)/t12-,13+/m0/s1