methyl 6-[(2-pyrazol-1-ylphenyl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(2-pyrazol-1-ylphenyl)carbonylamino]hexanoate Openeye Name: methyl 6-[(2-pyrazol-1-ylbenzoyl)amino]hexanoate CAS Name: 6-[[oxo-[2-(1-pyrazolyl)phenyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-pyrazol-1-ylbenzoyl)amino]hexanoate Traditional Name: 6-[(2-pyrazol-1-ylbenzoyl)amino]hexanoic acid methyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1=CC=CC=C1N2C=CC=N2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1=CC=CC=C1N2C=CC=N2

InChI

InChI=1S/C17H21N3O3/c1-23-16(21)10-3-2-6-11-18-17(22)14-8-4-5-9-15(14)20-13-7-12-19-20/h4-5,7-9,12-13H,2-3,6,10-11H2,1H3,(H,18,22)