2-[(5-bromanyl-1H-indol-3-yl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid

Systemtic Name: 2-[(5-bromanyl-1H-indol-3-yl)methyl]-3-oxidanyl-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Openeye Name: 2-[(5-bromo-1H-indol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid CAS Name: 2-[(5-bromo-1H-indol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid IUPAC Name: 2-[(5-bromo-1H-indol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Traditional Name: 2-[(5-bromo-1H-indol-3-yl)methyl]-3-hydroxy-7,8,9,10-tetrahydrobenzo[h]quinoline-4-carboxylic acid Formula: C23H19BrN2O3 MolecularWeight: 451.31256

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CNC5=C4C=C(C=C5)Br)O)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)C=CC3=C(C(=C(N=C23)CC4=CNC5=C4C=C(C=C5)Br)O)C(=O)O

InChI

InChI=1S/C23H19BrN2O3/c24-14-6-8-18-17(10-14)13(11-25-18)9-19-22(27)20(23(28)29)16-7-5-12-3-1-2-4-15(12)21(16)26-19/h5-8,10-11,25,27H,1-4,9H2,(H,28,29)