cyclooctyl 4-methylidene-2-oxidanylidene-6-phenyl-1,3-diazinane-5-carboxylate

Systemtic Name: cyclooctyl 4-methylidene-2-oxidanylidene-6-phenyl-1,3-diazinane-5-carboxylate Openeye Name: cyclooctyl 4-methylene-2-oxo-6-phenyl-hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-2-oxo-6-phenyl-1,3-diazinane-5-carboxylic acid cyclooctyl ester IUPAC Name: cyclooctyl 4-methylidene-2-oxo-6-phenyl-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-methylene-6-phenyl-hexahydropyrimidine-5-carboxylic acid cyclooctyl ester Formula: C20H26N2O3 MolecularWeight: 342.43204

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C(NC(=O)N1)C2=CC=CC=C2)C(=O)OC3CCCCCCC3

Isomeric SMILES

C=C1C(C(NC(=O)N1)C2=CC=CC=C2)C(=O)OC3CCCCCCC3

InChI

InChI=1S/C20H26N2O3/c1-14-17(19(23)25-16-12-8-3-2-4-9-13-16)18(22-20(24)21-14)15-10-6-5-7-11-15/h5-7,10-11,16-18H,1-4,8-9,12-13H2,(H2,21,22,24)