cycloheptyl 4-methylidene-2-oxidanylidene-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylate

Systemtic Name: cycloheptyl 4-methylidene-2-oxidanylidene-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylate Openeye Name: cycloheptyl 4-methylene-2-oxo-6-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-5-carboxylate CAS Name: 4-methylene-2-oxo-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylic acid cycloheptyl ester IUPAC Name: cycloheptyl 4-methylidene-2-oxo-6-(3,4,5-trimethoxyphenyl)-1,3-diazinane-5-carboxylate Traditional Name: 2-keto-4-methylene-6-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-5-carboxylic acid cycloheptyl ester Formula: C22H30N2O6 MolecularWeight: 418.4834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCCC3

InChI

InChI=1S/C22H30N2O6/c1-13-18(21(25)30-15-9-7-5-6-8-10-15)19(24-22(26)23-13)14-11-16(27-2)20(29-4)17(12-14)28-3/h11-12,15,18-19H,1,5-10H2,2-4H3,(H2,23,24,26)