methyl 7-[(5-ethyl-1-phenyl-pyrazol-4-yl)carbonylamino]heptanoate

Systemtic Name: methyl 7-[(5-ethyl-1-phenyl-pyrazol-4-yl)carbonylamino]heptanoate Openeye Name: methyl 7-[(5-ethyl-1-phenyl-pyrazole-4-carbonyl)amino]heptanoate CAS Name: 7-[[(5-ethyl-1-phenyl-4-pyrazolyl)-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[(5-ethyl-1-phenylpyrazole-4-carbonyl)amino]heptanoate Traditional Name: 7-[(5-ethyl-1-phenyl-pyrazole-4-carbonyl)amino]enanthic acid methyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=CC=C2)C(=O)NCCCCCCC(=O)OC

Isomeric SMILES

CCC1=C(C=NN1C2=CC=CC=C2)C(=O)NCCCCCCC(=O)OC

InChI

InChI=1S/C20H27N3O3/c1-3-18-17(15-22-23(18)16-11-7-6-8-12-16)20(25)21-14-10-5-4-9-13-19(24)26-2/h6-8,11-12,15H,3-5,9-10,13-14H2,1-2H3,(H,21,25)