4-[[1-[(3,5-dimethylphenoxy)methyl]pyrazol-3-yl]carbonylamino]butanoyl chloride

Systemtic Name: 4-[[1-[(3,5-dimethylphenoxy)methyl]pyrazol-3-yl]carbonylamino]butanoyl chloride Openeye Name: 4-[[1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carbonyl]amino]butanoyl chloride CAS Name: 4-[[[1-[(3,5-dimethylphenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]butanoyl chloride IUPAC Name: 4-[[1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carbonyl]amino]butanoyl chloride Traditional Name: 4-[[1-[(3,5-dimethylphenoxy)methyl]pyrazole-3-carbonyl]amino]butyryl chloride Formula: C17H20ClN3O3 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCC(=O)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCC(=O)Cl)C

InChI

InChI=1S/C17H20ClN3O3/c1-12-8-13(2)10-14(9-12)24-11-21-7-5-15(20-21)17(23)19-6-3-4-16(18)22/h5,7-10H,3-4,6,11H2,1-2H3,(H,19,23)