2-(4-dimethylaminophenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylic acid

Systemtic Name: 2-(4-dimethylaminophenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylic acid Openeye Name: 2-(4-dimethylaminophenyl)-1-(p-tolylsulfonyl)-3,6-dihydro-2H-pyridine-5-carboxylic acid CAS Name: 2-(4-dimethylaminophenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylic acid IUPAC Name: 2-(4-dimethylaminophenyl)-1-(4-methylphenyl)sulfonyl-3,6-dihydro-2H-pyridine-5-carboxylic acid Traditional Name: 2-(4-dimethylaminophenyl)-1-tosyl-3,6-dihydro-2H-pyridine-5-carboxylic acid Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=CCC2C3=CC=C(C=C3)N(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=CCC2C3=CC=C(C=C3)N(C)C)C(=O)O

InChI

InChI=1S/C21H24N2O4S/c1-15-4-11-19(12-5-15)28(26,27)23-14-17(21(24)25)8-13-20(23)16-6-9-18(10-7-16)22(2)3/h4-12,20H,13-14H2,1-3H3,(H,24,25)