methyl 4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 4-[(1-butyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]benzoate CAS Name: 4-[[(1-butyl-5-chloro-3-methyl-4-pyrazolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-butyl-5-chloro-3-methylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 4-[(1-butyl-5-chloro-3-methyl-pyrazole-4-carbonyl)amino]benzoic acid methyl ester Formula: C17H20ClN3O3 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)NC2=CC=C(C=C2)C(=O)OC)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)NC2=CC=C(C=C2)C(=O)OC)Cl

InChI

InChI=1S/C17H20ClN3O3/c1-4-5-10-21-15(18)14(11(2)20-21)16(22)19-13-8-6-12(7-9-13)17(23)24-3/h6-9H,4-5,10H2,1-3H3,(H,19,22)