tert-butyl 4-(2-chlorophenyl)-5-(4-methoxyphenyl)sulfonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: tert-butyl 4-(2-chlorophenyl)-5-(4-methoxyphenyl)sulfonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Openeye Name: tert-butyl 4-(2-chlorophenyl)-5-(4-methoxyphenyl)sulfonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chlorophenyl)-5-(4-methoxyphenyl)sulfonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-chlorophenyl)-5-(4-methoxyphenyl)sulfonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-5-(4-methoxyphenyl)sulfonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid tert-butyl ester Formula: C25H28ClNO5S MolecularWeight: 490.01152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28ClNO5S/c1-15-21(24(28)32-25(3,4)5)22(19-9-7-8-10-20(19)26)23(16(2)27-15)33(29,30)18-13-11-17(31-6)12-14-18/h7-14,22,27H,1-6H3