ethyl 2,6-dimethyl-4-(3-nitrophenyl)-6-oxidanyl-4,5-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2,6-dimethyl-4-(3-nitrophenyl)-6-oxidanyl-4,5-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-hydroxy-2,6-dimethyl-4-(3-nitrophenyl)-4,5-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C15H19N3O5 MolecularWeight: 321.32846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1(C)O)C)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1(C)O)C)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O5/c1-4-23-14(19)12-13(16-9(2)17-15(12,3)20)10-6-5-7-11(8-10)18(21)22/h5-8,12-13,20H,4H2,1-3H3,(H,16,17)