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

Systemtic Name: propan-2-yl (6S)-3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl (6S)-3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl (6S)-3-(1,3-benzodioxol-5-yl)-4-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-(1,3-benzodioxol-5-yl)-2-keto-4-methyl-6-phenyl-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C(=O)OC(C)C

InChI

InChI=1S/C22H22N2O5/c1-13(2)29-21(25)19-14(3)24(16-9-10-17-18(11-16)28-12-27-17)22(26)23-20(19)15-7-5-4-6-8-15/h4-11,13,20H,12H2,1-3H3,(H,23,26)/t20-/m0/s1