[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)amino]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-keto-ethyl] ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)NC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCCC(=O)OCC(=O)NC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C17H21N3O3/c1-4-8-16(22)23-11-15(21)18-17-12(2)19-20(13(17)3)14-9-6-5-7-10-14/h5-7,9-10H,4,8,11H2,1-3H3,(H,18,21)