1-(2,5-dimethylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid

Systemtic Name: 1-(2,5-dimethylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid Openeye Name: 1-(2,5-dimethylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid CAS Name: 1-(2,5-dimethylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid IUPAC Name: 1-(2,5-dimethylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid Traditional Name: 1-(2,5-dimethylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylic acid Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O2/c1-11-8-9-12(2)15(10-11)19-14-7-5-3-4-6-13(14)16(18-19)17(20)21/h8-10H,3-7H2,1-2H3,(H,20,21)