1-[(1-methylpyrazol-4-yl)amino]isoquinoline-3-carboxylic acid

Systemtic Name: 1-[(1-methylpyrazol-4-yl)amino]isoquinoline-3-carboxylic acid Openeye Name: 1-[(1-methylpyrazol-4-yl)amino]isoquinoline-3-carboxylic acid CAS Name: 1-[(1-methyl-4-pyrazolyl)amino]-3-isoquinolinecarboxylic acid IUPAC Name: 1-[(1-methylpyrazol-4-yl)amino]isoquinoline-3-carboxylic acid Traditional Name: 1-[(1-methylpyrazol-4-yl)amino]isoquinoline-3-carboxylic acid Formula: C14H12N4O2 MolecularWeight: 268.27068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)NC2=NC(=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CN1C=C(C=N1)NC2=NC(=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C14H12N4O2/c1-18-8-10(7-15-18)16-13-11-5-3-2-4-9(11)6-12(17-13)14(19)20/h2-8H,1H3,(H,16,17)(H,19,20)