2-[(E)-2-(3-methylthiophen-2-yl)ethenyl]quinoline-4-carboxylate

Systemtic Name: 2-[(E)-2-(3-methylthiophen-2-yl)ethenyl]quinoline-4-carboxylate Openeye Name: 2-[(E)-2-(3-methyl-2-thienyl)vinyl]quinoline-4-carboxylate CAS Name: 2-[(E)-2-(3-methyl-2-thiophenyl)ethenyl]-4-quinolinecarboxylate IUPAC Name: 2-[(E)-2-(3-methylthiophen-2-yl)ethenyl]quinoline-4-carboxylate Traditional Name: 2-[(E)-2-(3-methyl-2-thienyl)vinyl]cinchoninate Formula: C17H12NO2S- MolecularWeight: 294.34768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=CC2=NC3=CC=CC=C3C(=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(SC=C1)/C=C/C2=NC3=CC=CC=C3C(=C2)C(=O)[O-]

InChI

InChI=1S/C17H13NO2S/c1-11-8-9-21-16(11)7-6-12-10-14(17(19)20)13-4-2-3-5-15(13)18-12/h2-10H,1H3,(H,19,20)/p-1/b7-6+