6-bromanyl-2-[(E)-2-cyclohexylethenyl]quinoline-4-carboxylic acid

Systemtic Name: 6-bromanyl-2-[(E)-2-cyclohexylethenyl]quinoline-4-carboxylic acid Openeye Name: 6-bromo-2-[(E)-2-cyclohexylvinyl]quinoline-4-carboxylic acid CAS Name: 6-bromo-2-[(E)-2-cyclohexylethenyl]-4-quinolinecarboxylic acid IUPAC Name: 6-bromo-2-[(E)-2-cyclohexylethenyl]quinoline-4-carboxylic acid Traditional Name: 6-bromo-2-[(E)-2-cyclohexylvinyl]cinchoninic acid Formula: C18H18BrNO2 MolecularWeight: 360.24502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C=CC2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)/C=C/C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)O

InChI

InChI=1S/C18H18BrNO2/c19-13-7-9-17-15(10-13)16(18(21)22)11-14(20-17)8-6-12-4-2-1-3-5-12/h6-12H,1-5H2,(H,21,22)/b8-6+