propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,2-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,2-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 2,6-dimethyl-4-(2-nitrophenyl)-1,2-dihydropyrimidine-5-carboxylate CAS Name: 2,6-dimethyl-4-(2-nitrophenyl)-1,2-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,2-dihydropyrimidine-5-carboxylate Traditional Name: 2,6-dimethyl-4-(2-nitrophenyl)-1,2-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC1NC(=C(C(=N1)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC(C)C)C

Isomeric SMILES

CC1NC(=C(C(=N1)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC(C)C)C

InChI

InChI=1S/C16H19N3O4/c1-9(2)23-16(20)14-10(3)17-11(4)18-15(14)12-7-5-6-8-13(12)19(21)22/h5-9,11,17H,1-4H3