phenethyl 4-(4-ethoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: phenethyl 4-(4-ethoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: phenethyl 4-(4-ethoxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(4-ethoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid phenethyl ester IUPAC Name: phenethyl 4-(4-ethoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-methylene-6-p-phenetyl-hexahydropyrimidine-5-carboxylic acid phenethyl ester Formula: C22H24N2O4 MolecularWeight: 380.43696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O4/c1-3-27-18-11-9-17(10-12-18)20-19(15(2)23-22(26)24-20)21(25)28-14-13-16-7-5-4-6-8-16/h4-12,19-20H,2-3,13-14H2,1H3,(H2,23,24,26)