6-bromanyl-2-cyclopropyl-quinoline-4-carboxylate

Systemtic Name: 6-bromanyl-2-cyclopropyl-quinoline-4-carboxylate Openeye Name: 6-bromo-2-cyclopropyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-cyclopropyl-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-cyclopropylquinoline-4-carboxylate Traditional Name: 6-bromo-2-cyclopropyl-cinchoninate Formula: C13H9BrNO2- MolecularWeight: 291.12006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

Isomeric SMILES

C1CC1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

InChI

InChI=1S/C13H10BrNO2/c14-8-3-4-11-9(5-8)10(13(16)17)6-12(15-11)7-1-2-7/h3-7H,1-2H2,(H,16,17)/p-1