1-(3,5-dimethylpyrazol-1-yl)isoquinoline-3-carboxylic acid

Systemtic Name: 1-(3,5-dimethylpyrazol-1-yl)isoquinoline-3-carboxylic acid Openeye Name: 1-(3,5-dimethylpyrazol-1-yl)isoquinoline-3-carboxylic acid CAS Name: 1-(3,5-dimethyl-1-pyrazolyl)-3-isoquinolinecarboxylic acid IUPAC Name: 1-(3,5-dimethylpyrazol-1-yl)isoquinoline-3-carboxylic acid Traditional Name: 1-(3,5-dimethylpyrazol-1-yl)isoquinoline-3-carboxylic acid Formula: C15H13N3O2 MolecularWeight: 267.28262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC(=CC3=CC=CC=C32)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1C2=NC(=CC3=CC=CC=C32)C(=O)O)C

InChI

InChI=1S/C15H13N3O2/c1-9-7-10(2)18(17-9)14-12-6-4-3-5-11(12)8-13(16-14)15(19)20/h3-8H,1-2H3,(H,19,20)