3-methyl-2-[(E)-2-pyridin-3-ylethenyl]-1-benzothiophene-5-carboxylic acid

Systemtic Name: 3-methyl-2-[(E)-2-pyridin-3-ylethenyl]-1-benzothiophene-5-carboxylic acid Openeye Name: 3-methyl-2-[(E)-2-(3-pyridyl)vinyl]benzothiophene-5-carboxylic acid CAS Name: 3-methyl-2-[(E)-2-(3-pyridinyl)ethenyl]-1-benzothiophene-5-carboxylic acid IUPAC Name: 3-methyl-2-[(E)-2-pyridin-3-ylethenyl]-1-benzothiophene-5-carboxylic acid Traditional Name: 3-methyl-2-[(E)-2-(3-pyridyl)vinyl]benzothiophene-5-carboxylic acid Formula: C17H13NO2S MolecularWeight: 295.35562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)C(=O)O)C=CC3=CN=CC=C3

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)C(=O)O)/C=C/C3=CN=CC=C3

InChI

InChI=1S/C17H13NO2S/c1-11-14-9-13(17(19)20)5-7-16(14)21-15(11)6-4-12-3-2-8-18-10-12/h2-10H,1H3,(H,19,20)/b6-4+