1-(4-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid Openeye Name: 1-(p-tolyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid CAS Name: 1-(4-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid IUPAC Name: 1-(4-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid Traditional Name: 1-(p-tolyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid Formula: C16H18N2O2 MolecularWeight: 270.32632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(CCCCC3)C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(CCCCC3)C(=N2)C(=O)O

InChI

InChI=1S/C16H18N2O2/c1-11-7-9-12(10-8-11)18-14-6-4-2-3-5-13(14)15(17-18)16(19)20/h7-10H,2-6H2,1H3,(H,19,20)