cyclohexyl (4S,5R)-4-(3-methoxy-4-propoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: cyclohexyl (4S,5R)-4-(3-methoxy-4-propoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: cyclohexyl (4S,5R)-4-(3-methoxy-4-propoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (4S,5R)-4-(3-methoxy-4-propoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl (4S,5R)-4-(3-methoxy-4-propoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (4S,5R)-2-keto-4-(3-methoxy-4-propoxy-phenyl)-6-methylene-hexahydropyrimidine-5-carboxylic acid cyclohexyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCC3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)OC3CCCCC3)OC

InChI

InChI=1S/C22H30N2O5/c1-4-12-28-17-11-10-15(13-18(17)27-3)20-19(14(2)23-22(26)24-20)21(25)29-16-8-6-5-7-9-16/h10-11,13,16,19-20H,2,4-9,12H2,1,3H3,(H2,23,24,26)/t19-,20+/m0/s1