ethyl 6-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-oxomethoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepine-8-carbonyl)oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-carbonyl)oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H21ClN2O7 MolecularWeight: 424.83224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C19H21ClN2O7/c1-3-26-18(24)15-10(2)21-19(25)22-13(15)9-29-17(23)11-7-12(20)16-14(8-11)27-5-4-6-28-16/h7-8,10H,3-6,9H2,1-2H3,(H2,21,22,25)