ethyl 4-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[5-(2-chloranyl-4-nitro-phenyl)furan-2-yl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[5-(2-chloro-4-nitrophenyl)-2-furanyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[5-(2-chloro-4-nitro-phenyl)-2-furyl]-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H16ClN3O6 MolecularWeight: 405.78914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H16ClN3O6/c1-3-27-17(23)15-9(2)20-18(24)21-16(15)14-7-6-13(28-14)11-5-4-10(22(25)26)8-12(11)19/h4-8,16H,3H2,1-2H3,(H2,20,21,24)