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

Systemtic Name: 4-(3-chloranyl-2-methyl-phenyl)-2-(fluoranylmethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: 4-(3-chloro-2-methyl-phenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(3-chloro-2-methylphenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate IUPAC Name: 4-(3-chloro-2-methylphenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(3-chloro-2-methyl-phenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylate Formula: C16H13ClFNO4-2 MolecularWeight: 337.730123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)C2C(=C(NC(=C2C(=O)[O-])CF)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1Cl)C2C(=C(NC(=C2C(=O)[O-])CF)C)C(=O)[O-]

InChI

InChI=1S/C16H15ClFNO4/c1-7-9(4-3-5-10(7)17)13-12(15(20)21)8(2)19-11(6-18)14(13)16(22)23/h3-5,13,19H,6H2,1-2H3,(H,20,21)(H,22,23)/p-2