5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxylic acid

Systemtic Name: 5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxylic acid Openeye Name: 5-methyl-2-(3-methylsulfonyl-2-naphthyl)pyrazole-3-carboxylic acid CAS Name: 5-methyl-2-(3-methylsulfonyl-2-naphthalenyl)-3-pyrazolecarboxylic acid IUPAC Name: 5-methyl-2-(3-methylsulfonylnaphthalen-2-yl)pyrazole-3-carboxylic acid Traditional Name: 2-(3-mesyl-2-naphthyl)-5-methyl-pyrazole-3-carboxylic acid Formula: C16H14N2O4S MolecularWeight: 330.35836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)O)C2=CC3=CC=CC=C3C=C2S(=O)(=O)C

Isomeric SMILES

CC1=NN(C(=C1)C(=O)O)C2=CC3=CC=CC=C3C=C2S(=O)(=O)C

InChI

InChI=1S/C16H14N2O4S/c1-10-7-14(16(19)20)18(17-10)13-8-11-5-3-4-6-12(11)9-15(13)23(2,21)22/h3-9H,1-2H3,(H,19,20)