(E)-3-(3,4-dimethoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3,4-dimethoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3,4-dimethoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid CAS Name: (E)-3-[3,4-dimethoxy-5-(1-pyrrolidinylsulfonyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(3,4-dimethoxy-5-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(3,4-dimethoxy-5-pyrrolidinosulfonyl-phenyl)acrylic acid Formula: C15H19NO6S MolecularWeight: 341.37946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)O)S(=O)(=O)N2CCCC2)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)O)S(=O)(=O)N2CCCC2)OC

InChI

InChI=1S/C15H19NO6S/c1-21-12-9-11(5-6-14(17)18)10-13(15(12)22-2)23(19,20)16-7-3-4-8-16/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,17,18)/b6-5+