6-bromanyl-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid Openeye Name: 6-bromo-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid CAS Name: 6-bromo-2-(2-ethoxyphenyl)-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-2-(2-ethoxyphenyl)quinoline-4-carboxylic acid Traditional Name: 6-bromo-2-o-phenetyl-cinchoninic acid Formula: C18H14BrNO3 MolecularWeight: 372.21266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)O

InChI

InChI=1S/C18H14BrNO3/c1-2-23-17-6-4-3-5-12(17)16-10-14(18(21)22)13-9-11(19)7-8-15(13)20-16/h3-10H,2H2,1H3,(H,21,22)