(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanoate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]ethanoate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetate CAS Name: 2-[3,5-dimethyl-1-(2-methylpropyl)-4-pyrazolyl]acetic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetate Traditional Name: 2-(1-isobutyl-3,5-dimethyl-pyrazol-4-yl)acetic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C22H26ClN3O3 MolecularWeight: 415.91314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(C)C)C)CC(=O)OCC2=C(N=C3C=C(C=CC3=C2)OC)Cl

Isomeric SMILES

CC1=C(C(=NN1CC(C)C)C)CC(=O)OCC2=C(N=C3C=C(C=CC3=C2)OC)Cl

InChI

InChI=1S/C22H26ClN3O3/c1-13(2)11-26-15(4)19(14(3)25-26)10-21(27)29-12-17-8-16-6-7-18(28-5)9-20(16)24-22(17)23/h6-9,13H,10-12H2,1-5H3