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

Systemtic Name: 5-isoquinolin-5-yl-1-propyl-pyrrole-2-carboxylic acid Openeye Name: 5-(5-isoquinolyl)-1-propyl-pyrrole-2-carboxylic acid CAS Name: 5-(5-isoquinolinyl)-1-propyl-2-pyrrolecarboxylic acid IUPAC Name: 5-isoquinolin-5-yl-1-propylpyrrole-2-carboxylic acid Traditional Name: 5-(5-isoquinolyl)-1-propyl-pyrrole-2-carboxylic acid Formula: C17H16N2O2 MolecularWeight: 280.32114

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC=C1C(=O)O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCN1C(=CC=C1C(=O)O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H16N2O2/c1-2-10-19-15(6-7-16(19)17(20)21)14-5-3-4-12-11-18-9-8-13(12)14/h3-9,11H,2,10H2,1H3,(H,20,21)