9-bromanyl-11-methyl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid

Systemtic Name: 9-bromanyl-11-methyl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid Openeye Name: 9-bromo-11-methyl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid CAS Name: 9-bromo-11-methyl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid IUPAC Name: 9-bromo-11-methyl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid Traditional Name: 9-bromo-11-methyl-1,2,3,4,5,6-hexahydroazepino[2,3-b]quinoline-2-carboxylic acid Formula: C15H17BrN2O2 MolecularWeight: 337.21168

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC3=C1NC(CCC3)C(=O)O)C=CC(=C2)Br

Isomeric SMILES

CN1C2=C(CC3=C1NC(CCC3)C(=O)O)C=CC(=C2)Br

InChI

InChI=1S/C15H17BrN2O2/c1-18-13-8-11(16)6-5-9(13)7-10-3-2-4-12(15(19)20)17-14(10)18/h5-6,8,12,17H,2-4,7H2,1H3,(H,19,20)