(E)-3-(2-prop-2-enoxyphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate

Systemtic Name: (E)-3-(2-prop-2-enoxyphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Openeye Name: (E)-3-(2-allyloxyphenyl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(2-prop-2-enoxyphenyl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]-2-propenoate IUPAC Name: (E)-3-(2-prop-2-enoxyphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(2-allyloxyphenyl)-2-(5-pyrrolidinosulfonyl-2-thienyl)acrylate Formula: C20H20NO5S2- MolecularWeight: 418.5065

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1C=C(C2=CC=C(S2)S(=O)(=O)N3CCCC3)C(=O)[O-]

Isomeric SMILES

C=CCOC1=CC=CC=C1/C=C(/C2=CC=C(S2)S(=O)(=O)N3CCCC3)\C(=O)[O-]

InChI

InChI=1S/C20H21NO5S2/c1-2-13-26-17-8-4-3-7-15(17)14-16(20(22)23)18-9-10-19(27-18)28(24,25)21-11-5-6-12-21/h2-4,7-10,14H,1,5-6,11-13H2,(H,22,23)/p-1/b16-14-