methyl 6-[(5-methyl-1-phenyl-pyrazol-4-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(5-methyl-1-phenyl-pyrazol-4-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[(5-methyl-1-phenyl-pyrazole-4-carbonyl)amino]hexanoate CAS Name: 6-[[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(5-methyl-1-phenylpyrazole-4-carbonyl)amino]hexanoate Traditional Name: 6-[(5-methyl-1-phenyl-pyrazole-4-carbonyl)amino]hexanoic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C18H23N3O3/c1-14-16(13-20-21(14)15-9-5-3-6-10-15)18(23)19-12-8-4-7-11-17(22)24-2/h3,5-6,9-10,13H,4,7-8,11-12H2,1-2H3,(H,19,23)