cyclooctyl 4-(3-methoxy-4-phenylmethoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: cyclooctyl 4-(3-methoxy-4-phenylmethoxy-phenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: cyclooctyl 4-(4-benzyloxy-3-methoxy-phenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: 4-(3-methoxy-4-phenylmethoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxylic acid cyclooctyl ester IUPAC Name: cyclooctyl 4-(3-methoxy-4-phenylmethoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: 4-(4-benzoxy-3-methoxy-phenyl)-2-keto-6-methylene-hexahydropyrimidine-5-carboxylic acid cyclooctyl ester Formula: C28H34N2O5 MolecularWeight: 478.57996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCCCC3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(=C)NC(=O)N2)C(=O)OC3CCCCCCC3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H34N2O5/c1-19-25(27(31)35-22-13-9-4-3-5-10-14-22)26(30-28(32)29-19)21-15-16-23(24(17-21)33-2)34-18-20-11-7-6-8-12-20/h6-8,11-12,15-17,22,25-26H,1,3-5,9-10,13-14,18H2,2H3,(H2,29,30,32)