methyl 4-(2-chlorophenyl)-2,6-dimethyl-5-(phenylsulfonyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 4-(2-chlorophenyl)-2,6-dimethyl-5-(phenylsulfonyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-(benzenesulfonyl)-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-(benzenesulfonyl)-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(benzenesulfonyl)-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-besyl-4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C21H20ClNO4S MolecularWeight: 417.9058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3Cl)C(=O)OC

InChI

InChI=1S/C21H20ClNO4S/c1-13-18(21(24)27-3)19(16-11-7-8-12-17(16)22)20(14(2)23-13)28(25,26)15-9-5-4-6-10-15/h4-12,19,23H,1-3H3