methyl 2-[4-(3,4,5-trimethylpyrazol-1-yl)phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-8-carboxylate

Systemtic Name: methyl 2-[4-(3,4,5-trimethylpyrazol-1-yl)phenyl]carbonyl-3,4-dihydro-1H-isoquinoline-8-carboxylate Openeye Name: methyl 2-[4-(3,4,5-trimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-8-carboxylate CAS Name: 2-[oxo-[4-(3,4,5-trimethyl-1-pyrazolyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-8-carboxylic acid methyl ester IUPAC Name: methyl 2-[4-(3,4,5-trimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-8-carboxylate Traditional Name: 2-[4-(3,4,5-trimethylpyrazol-1-yl)benzoyl]-3,4-dihydro-1H-isoquinoline-8-carboxylic acid methyl ester Formula: C24H25N3O3 MolecularWeight: 403.4736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)N3CCC4=CC=CC(=C4C3)C(=O)OC)C

Isomeric SMILES

CC1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)N3CCC4=CC=CC(=C4C3)C(=O)OC)C

InChI

InChI=1S/C24H25N3O3/c1-15-16(2)25-27(17(15)3)20-10-8-19(9-11-20)23(28)26-13-12-18-6-5-7-21(22(18)14-26)24(29)30-4/h5-11H,12-14H2,1-4H3