ethyl 6-(1,3-benzodioxol-5-yl)-3-methyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(1,3-benzodioxol-5-yl)-3-methyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(1,3-benzodioxol-5-yl)-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(1,3-benzodioxol-5-yl)-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(1,3-benzodioxol-5-yl)-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-keto-3-methyl-4-phenyl-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC3=C(C=C2)OCO3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC3=C(C=C2)OCO3)C)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O5/c1-3-26-20(24)17-18(14-9-10-15-16(11-14)28-12-27-15)22-21(25)23(2)19(17)13-7-5-4-6-8-13/h4-11,18H,3,12H2,1-2H3,(H,22,25)