propan-2-yl 2,6-dimethyl-5-nitro-4-(2-phenylquinolin-8-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: propan-2-yl 2,6-dimethyl-5-nitro-4-(2-phenylquinolin-8-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: isopropyl 2,6-dimethyl-5-nitro-4-(2-phenyl-8-quinolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-5-nitro-4-(2-phenyl-8-quinolinyl)-1,4-dihydropyridine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,6-dimethyl-5-nitro-4-(2-phenylquinolin-8-yl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-5-nitro-4-(2-phenyl-8-quinolyl)-1,4-dihydropyridine-3-carboxylic acid isopropyl ester Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC3=C2N=C(C=C3)C4=CC=CC=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC3=C2N=C(C=C3)C4=CC=CC=C4)C(=O)OC(C)C

InChI

InChI=1S/C26H25N3O4/c1-15(2)33-26(30)22-16(3)27-17(4)25(29(31)32)23(22)20-12-8-11-19-13-14-21(28-24(19)20)18-9-6-5-7-10-18/h5-15,23,27H,1-4H3