(Z)-7-(1-benzothiophen-2-yl)-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (Z)-7-(1-benzothiophen-2-yl)-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (Z)-7-(benzothiophen-2-yl)-7-(3-pyridyl)hept-6-enoic acid CAS Name: (Z)-7-(1-benzothiophen-2-yl)-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (Z)-7-(1-benzothiophen-2-yl)-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (Z)-7-(benzothiophen-2-yl)-7-(3-pyridyl)hept-6-enoic acid Formula: C20H19NO2S MolecularWeight: 337.43536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(S2)C(=CCCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(S2)/C(=C\CCCCC(=O)O)/C3=CN=CC=C3

InChI

InChI=1S/C20H19NO2S/c22-20(23)11-3-1-2-9-17(16-8-6-12-21-14-16)19-13-15-7-4-5-10-18(15)24-19/h4-10,12-14H,1-3,11H2,(H,22,23)/b17-9-