1-isoquinolin-5-yl-2,5-dimethyl-pyrrole-3-carboxylic acid

Systemtic Name: 1-isoquinolin-5-yl-2,5-dimethyl-pyrrole-3-carboxylic acid Openeye Name: 1-(5-isoquinolyl)-2,5-dimethyl-pyrrole-3-carboxylic acid CAS Name: 1-(5-isoquinolinyl)-2,5-dimethyl-3-pyrrolecarboxylic acid IUPAC Name: 1-isoquinolin-5-yl-2,5-dimethylpyrrole-3-carboxylic acid Traditional Name: 1-(5-isoquinolyl)-2,5-dimethyl-pyrrole-3-carboxylic acid Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC3=C2C=CN=C3)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC3=C2C=CN=C3)C)C(=O)O

InChI

InChI=1S/C16H14N2O2/c1-10-8-14(16(19)20)11(2)18(10)15-5-3-4-12-9-17-7-6-13(12)15/h3-9H,1-2H3,(H,19,20)