(E)-3-[5-chloranyl-2-(2-diethylaminoethyloxy)phenyl]-2-thiophen-2-yl-prop-2-enoic acid

Systemtic Name: (E)-3-[5-chloranyl-2-(2-diethylaminoethyloxy)phenyl]-2-thiophen-2-yl-prop-2-enoic acid Openeye Name: (E)-3-[5-chloro-2-(2-diethylaminoethyloxy)phenyl]-2-(2-thienyl)prop-2-enoic acid CAS Name: (E)-3-[5-chloro-2-(2-diethylaminoethyloxy)phenyl]-2-thiophen-2-yl-2-propenoic acid IUPAC Name: (E)-3-[5-chloro-2-(2-diethylaminoethyloxy)phenyl]-2-thiophen-2-ylprop-2-enoic acid Traditional Name: (E)-3-[5-chloro-2-(2-diethylaminoethyloxy)phenyl]-2-(2-thienyl)acrylic acid Formula: C19H22ClNO3S MolecularWeight: 379.90088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1)Cl)C=C(C2=CC=CS2)C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1)Cl)/C=C(/C2=CC=CS2)\C(=O)O

InChI

InChI=1S/C19H22ClNO3S/c1-3-21(4-2)9-10-24-17-8-7-15(20)12-14(17)13-16(19(22)23)18-6-5-11-25-18/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,22,23)/b16-13-