methyl 6-[[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[3-(o-tolyl)-1-phenyl-pyrazole-4-carbonyl]amino]hexanoate CAS Name: 6-[[[3-(2-methylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[3-(2-methylphenyl)-1-phenylpyrazole-4-carbonyl]amino]hexanoate Traditional Name: 6-[[3-(o-tolyl)-1-phenyl-pyrazole-4-carbonyl]amino]hexanoic acid methyl ester Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)NCCCCCC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)NCCCCCC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H27N3O3/c1-18-11-8-9-14-20(18)23-21(17-27(26-23)19-12-5-3-6-13-19)24(29)25-16-10-4-7-15-22(28)30-2/h3,5-6,8-9,11-14,17H,4,7,10,15-16H2,1-2H3,(H,25,29)