(5S)-5-methyl-1-(4-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid

Systemtic Name: (5S)-5-methyl-1-(4-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid Openeye Name: (5S)-5-methyl-1-(p-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid CAS Name: (5S)-5-methyl-1-(4-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid IUPAC Name: (5S)-5-methyl-1-(4-methylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid Traditional Name: (5S)-5-methyl-1-(p-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)C)C(=O)O

Isomeric SMILES

C[C@H]1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)C)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-10-3-6-12(7-4-10)18-14-8-5-11(2)9-13(14)15(17-18)16(19)20/h3-4,6-7,11H,5,8-9H2,1-2H3,(H,19,20)/t11-/m0/s1