3-(4-methoxyphenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)prop-2-enoic acid

Systemtic Name: 3-(4-methoxyphenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)prop-2-enoic acid Openeye Name: 3-(4-methoxyphenyl)-2-(5-morpholinosulfonyl-2-thienyl)prop-2-enoic acid CAS Name: 3-(4-methoxyphenyl)-2-[5-(4-morpholinylsulfonyl)-2-thiophenyl]-2-propenoic acid IUPAC Name: 3-(4-methoxyphenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)prop-2-enoic acid Traditional Name: 3-(4-methoxyphenyl)-2-(5-morpholinosulfonyl-2-thienyl)acrylic acid Formula: C18H19NO6S2 MolecularWeight: 409.47656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C2=CC=C(S2)S(=O)(=O)N3CCOCC3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C=C(C2=CC=C(S2)S(=O)(=O)N3CCOCC3)C(=O)O

InChI

InChI=1S/C18H19NO6S2/c1-24-14-4-2-13(3-5-14)12-15(18(20)21)16-6-7-17(26-16)27(22,23)19-8-10-25-11-9-19/h2-7,12H,8-11H2,1H3,(H,20,21)