1-[4-(5-methylpyrazol-1-yl)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[4-(5-methylpyrazol-1-yl)phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-[4-(5-methylpyrazol-1-yl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[4-(5-methyl-1-pyrazolyl)phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-[4-(5-methylpyrazol-1-yl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[4-(5-methylpyrazol-1-yl)benzoyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N3CCCC4=C(C=CC=C43)C(=O)O

Isomeric SMILES

CC1=CC=NN1C2=CC=C(C=C2)C(=O)N3CCCC4=C(C=CC=C43)C(=O)O

InChI

InChI=1S/C21H19N3O3/c1-14-11-12-22-24(14)16-9-7-15(8-10-16)20(25)23-13-3-5-17-18(21(26)27)4-2-6-19(17)23/h2,4,6-12H,3,5,13H2,1H3,(H,26,27)