2,6-dimethyl-4-(3-nitrophenyl)-5-pyrimidin-5-yl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-pyrimidin-5-yl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-pyrimidin-5-yl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(5-pyrimidinyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-pyrimidin-5-yl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(5-pyrimidyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CN=CN=C3

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CN=CN=C3

InChI

InChI=1S/C18H16N4O4/c1-10-15(13-7-19-9-20-8-13)17(16(18(23)24)11(2)21-10)12-4-3-5-14(6-12)22(25)26/h3-9,17,21H,1-2H3,(H,23,24)