2-methoxyethyl (6S)-4-methyl-6-(2-nitrophenyl)-2-oxidanylidene-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl (6S)-4-methyl-6-(2-nitrophenyl)-2-oxidanylidene-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl (6S)-3-benzyl-4-methyl-6-(2-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6S)-4-methyl-6-(2-nitrophenyl)-2-oxo-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (6S)-3-benzyl-4-methyl-6-(2-nitrophenyl)-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6S)-3-benzyl-2-keto-4-methyl-6-(2-nitrophenyl)-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-])C(=O)OCCOC

Isomeric SMILES

CC1=C([C@@H](NC(=O)N1CC2=CC=CC=C2)C3=CC=CC=C3[N+](=O)[O-])C(=O)OCCOC

InChI

InChI=1S/C22H23N3O6/c1-15-19(21(26)31-13-12-30-2)20(17-10-6-7-11-18(17)25(28)29)23-22(27)24(15)14-16-8-4-3-5-9-16/h3-11,20H,12-14H2,1-2H3,(H,23,27)/t20-/m0/s1