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

Systemtic Name: (E)-3-(3-prop-2-enoxyphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Openeye Name: (E)-3-(3-allyloxyphenyl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)prop-2-enoate CAS Name: (E)-3-(3-prop-2-enoxyphenyl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]-2-propenoate IUPAC Name: (E)-3-(3-prop-2-enoxyphenyl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)prop-2-enoate Traditional Name: (E)-3-(3-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(=C1)C=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/c1-2-12-26-16-7-5-6-15(13-16)14-17(20(22)23)18-8-9-19(27-18)28(24,25)21-10-3-4-11-21/h2,5-9,13-14H,1,3-4,10-12H2,(H,22,23)/p-1/b17-14-