methyl 6-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]hexanoate CAS Name: 6-[[[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(1-benzyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]hexanoate Traditional Name: 6-[(1-benzyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]hexanoic acid methyl ester Formula: C19H24ClN3O3 MolecularWeight: 377.86516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCCCC(=O)OC)Cl)CC2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCCCC(=O)OC)Cl)CC2=CC=CC=C2

InChI

InChI=1S/C19H24ClN3O3/c1-14-17(19(25)21-12-8-4-7-11-16(24)26-2)18(20)23(22-14)13-15-9-5-3-6-10-15/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3,(H,21,25)