3-[(4-bromanylisoquinolin-3-yl)methyl]-2-methyl-1H-indole-5-carboxylic acid

Systemtic Name: 3-[(4-bromanylisoquinolin-3-yl)methyl]-2-methyl-1H-indole-5-carboxylic acid Openeye Name: 3-[(4-bromo-3-isoquinolyl)methyl]-2-methyl-1H-indole-5-carboxylic acid CAS Name: 3-[(4-bromo-3-isoquinolinyl)methyl]-2-methyl-1H-indole-5-carboxylic acid IUPAC Name: 3-[(4-bromoisoquinolin-3-yl)methyl]-2-methyl-1H-indole-5-carboxylic acid Traditional Name: 3-[(4-bromo-3-isoquinolyl)methyl]-2-methyl-1H-indole-5-carboxylic acid Formula: C20H15BrN2O2 MolecularWeight: 395.2493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)C(=O)O)CC3=C(C4=CC=CC=C4C=N3)Br

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)C(=O)O)CC3=C(C4=CC=CC=C4C=N3)Br

InChI

InChI=1S/C20H15BrN2O2/c1-11-15(16-8-12(20(24)25)6-7-17(16)23-11)9-18-19(21)14-5-3-2-4-13(14)10-22-18/h2-8,10,23H,9H2,1H3,(H,24,25)