4-(2-chloranyl-6-fluoranyl-phenyl)-5-(cyclopentylmethyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)-5-(cyclopentylmethyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(2-chloro-6-fluoro-phenyl)-5-(cyclopentylmethyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(2-chloro-6-fluorophenyl)-5-(cyclopentylmethyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(2-chloro-6-fluorophenyl)-5-(cyclopentylmethyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(2-chloro-6-fluoro-phenyl)-5-(cyclopentylmethyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C20H23ClFNO2 MolecularWeight: 363.853523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C(C=CC=C2Cl)F)CC3CCCC3

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C(C=CC=C2Cl)F)CC3CCCC3

InChI

InChI=1S/C20H23ClFNO2/c1-11-14(10-13-6-3-4-7-13)18(17(20(24)25)12(2)23-11)19-15(21)8-5-9-16(19)22/h5,8-9,13,18,23H,3-4,6-7,10H2,1-2H3,(H,24,25)