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

Systemtic Name: 1-(3-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylate Openeye Name: 1-(m-tolyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylate CAS Name: 1-(3-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylate IUPAC Name: 1-(3-methylphenyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylate Traditional Name: 1-(m-tolyl)-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrazole-3-carboxylate Formula: C16H17N2O2- MolecularWeight: 269.31838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(CCCCC3)C(=N2)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(CCCCC3)C(=N2)C(=O)[O-]

InChI

InChI=1S/C16H18N2O2/c1-11-6-5-7-12(10-11)18-14-9-4-2-3-8-13(14)15(17-18)16(19)20/h5-7,10H,2-4,8-9H2,1H3,(H,19,20)/p-1