methyl (4S,5R)-4-(2-bromanyl-5-ethoxy-4-methoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: methyl (4S,5R)-4-(2-bromanyl-5-ethoxy-4-methoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl (4S,5R)-4-(2-bromo-5-ethoxy-4-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(2-bromo-5-ethoxy-4-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-4-(2-bromo-5-ethoxy-4-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-4-(2-bromo-5-ethoxy-4-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C16H19BrN2O5 MolecularWeight: 399.23646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C2C(C(=C)NC(=O)N2)C(=O)OC)Br)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC)Br)OC

InChI

InChI=1S/C16H19BrN2O5/c1-5-24-12-6-9(10(17)7-11(12)22-3)14-13(15(20)23-4)8(2)18-16(21)19-14/h6-7,13-14H,2,5H2,1,3-4H3,(H2,18,19,21)/t13-,14+/m0/s1