1-ethyl-5-isoquinolin-5-yl-pyrrole-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCN1C(=CC=C1C(=O)O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C16H14N2O2/c1-2-18-14(6-7-15(18)16(19)20)13-5-3-4-11-10-17-9-8-12(11)13/h3-10H,2H2,1H3,(H,19,20)