methyl 2-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]carbonyl-3,4-dihydro-1H-isoquinoline-6-carboxylate

Systemtic Name: methyl 2-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]carbonyl-3,4-dihydro-1H-isoquinoline-6-carboxylate Openeye Name: methyl 2-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-6-carboxylate CAS Name: 2-[[1-(4-fluorophenyl)-3,5-dimethyl-4-pyrazolyl]-oxomethyl]-3,4-dihydro-1H-isoquinoline-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-6-carboxylate Traditional Name: 2-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carbonyl]-3,4-dihydro-1H-isoquinoline-6-carboxylic acid methyl ester Formula: C23H22FN3O3 MolecularWeight: 407.437483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)N3CCC4=C(C3)C=CC(=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)N3CCC4=C(C3)C=CC(=C4)C(=O)OC

InChI

InChI=1S/C23H22FN3O3/c1-14-21(15(2)27(25-14)20-8-6-19(24)7-9-20)22(28)26-11-10-16-12-17(23(29)30-3)4-5-18(16)13-26/h4-9,12H,10-11,13H2,1-3H3