4-(5-azanyl-2-chloranyl-phenyl)-2-(fluoranylmethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: 4-(5-azanyl-2-chloranyl-phenyl)-2-(fluoranylmethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: 4-(5-amino-2-chloro-phenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(5-amino-2-chlorophenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate IUPAC Name: 4-(5-amino-2-chlorophenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(5-amino-2-chloro-phenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Formula: C15H12ClFN2O4-2 MolecularWeight: 338.718183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CF)C(=O)[O-])C2=C(C=CC(=C2)N)Cl)C(=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)CF)C(=O)[O-])C2=C(C=CC(=C2)N)Cl)C(=O)[O-]

InChI

InChI=1S/C15H14ClFN2O4/c1-6-11(14(20)21)12(8-4-7(18)2-3-9(8)16)13(15(22)23)10(5-17)19-6/h2-4,12,19H,5,18H2,1H3,(H,20,21)(H,22,23)/p-2