7-(1-adamantyl)-4-bromanyl-quinoline-2-carboxylic acid

Systemtic Name: 7-(1-adamantyl)-4-bromanyl-quinoline-2-carboxylic acid Openeye Name: 7-(1-adamantyl)-4-bromo-quinoline-2-carboxylic acid CAS Name: 7-(1-adamantyl)-4-bromo-2-quinolinecarboxylic acid IUPAC Name: 7-(1-adamantyl)-4-bromoquinoline-2-carboxylic acid Traditional Name: 7-(1-adamantyl)-4-bromo-quinaldic acid Formula: C20H20BrNO2 MolecularWeight: 386.2823

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)C(=CC(=N5)C(=O)O)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC5=C(C=C4)C(=CC(=N5)C(=O)O)Br

InChI

InChI=1S/C20H20BrNO2/c21-16-7-18(19(23)24)22-17-6-14(1-2-15(16)17)20-8-11-3-12(9-20)5-13(4-11)10-20/h1-2,6-7,11-13H,3-5,8-10H2,(H,23,24)