6-bromanyl-2-[(E)-2-thiophen-2-ylethenyl]quinoline-4-carboxylate

Systemtic Name: 6-bromanyl-2-[(E)-2-thiophen-2-ylethenyl]quinoline-4-carboxylate Openeye Name: 6-bromo-2-[(E)-2-(2-thienyl)vinyl]quinoline-4-carboxylate CAS Name: 6-bromo-2-[(E)-2-thiophen-2-ylethenyl]-4-quinolinecarboxylate IUPAC Name: 6-bromo-2-[(E)-2-thiophen-2-ylethenyl]quinoline-4-carboxylate Traditional Name: 6-bromo-2-[(E)-2-(2-thienyl)vinyl]cinchoninate Formula: C16H9BrNO2S- MolecularWeight: 359.21716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)/C=C/C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)[O-]

InChI

InChI=1S/C16H10BrNO2S/c17-10-3-6-15-13(8-10)14(16(19)20)9-11(18-15)4-5-12-2-1-7-21-12/h1-9H,(H,19,20)/p-1/b5-4+