2-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)pyrazol-1-yl]ethanoate

Systemtic Name: 2-[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)pyrazol-1-yl]ethanoate Openeye Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrazol-1-yl]acetate CAS Name: 2-[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-pyrazolyl]acetate IUPAC Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrazol-1-yl]acetate Traditional Name: 2-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)pyrazol-1-yl]acetate Formula: C15H14N3O3- MolecularWeight: 284.28996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=NN(C=C3)CC(=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=NN(C=C3)CC(=O)[O-]

InChI

InChI=1S/C15H15N3O3/c19-14(20)10-18-8-6-13(16-18)15(21)17-7-5-11-3-1-2-4-12(11)9-17/h1-4,6,8H,5,7,9-10H2,(H,19,20)/p-1