phenethyl 4-(3-ethoxy-4-oxidanyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: phenethyl 4-(3-ethoxy-4-oxidanyl-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: phenethyl 4-(3-ethoxy-4-hydroxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(3-ethoxy-4-hydroxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid phenethyl ester IUPAC Name: phenethyl 4-(3-ethoxy-4-hydroxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 4-(3-ethoxy-4-hydroxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid phenethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OCCC3=CC=CC=C3)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OCCC3=CC=CC=C3)O

InChI

InChI=1S/C22H24N2O5/c1-3-28-18-13-16(9-10-17(18)25)20-19(14(2)23-22(27)24-20)21(26)29-12-11-15-7-5-4-6-8-15/h4-10,13,19-20,25H,2-3,11-12H2,1H3,(H2,23,24,27)