(E)-3-[5-(pyridin-3-ylmethyl)thiophen-2-yl]prop-2-enoic acid hydrochloride

Systemtic Name: (E)-3-[5-(pyridin-3-ylmethyl)thiophen-2-yl]prop-2-enoic acid hydrochloride Openeye Name: (E)-3-[5-(3-pyridylmethyl)-2-thienyl]prop-2-enoic acid hydrochloride CAS Name: (E)-3-[5-(3-pyridinylmethyl)-2-thiophenyl]-2-propenoic acid hydrochloride IUPAC Name: (E)-3-[5-(pyridin-3-ylmethyl)thiophen-2-yl]prop-2-enoic acid hydrochloride Traditional Name: (E)-3-[5-(3-pyridylmethyl)-2-thienyl]acrylic acid hydrochloride Formula: C13H12ClNO2S MolecularWeight: 281.75788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CC=C(S2)C=CC(=O)O.Cl

Isomeric SMILES

C1=CC(=CN=C1)CC2=CC=C(S2)/C=C/C(=O)O.Cl

InChI

InChI=1S/C13H11NO2S.ClH/c15-13(16)6-5-11-3-4-12(17-11)8-10-2-1-7-14-9-10;/h1-7,9H,8H2,(H,15,16);1H/b6-5+;