(E)-2-methyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-methyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid Openeye Name: (E)-2-methyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid CAS Name: (E)-2-methyl-3-[3-(1-pyrrolidinylsulfonyl)phenyl]-2-propenoic acid IUPAC Name: (E)-2-methyl-3-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid Traditional Name: (E)-2-methyl-3-(3-pyrrolidinosulfonylphenyl)acrylic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C(=O)O

Isomeric SMILES

C/C(=C\C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)/C(=O)O

InChI

InChI=1S/C14H17NO4S/c1-11(14(16)17)9-12-5-4-6-13(10-12)20(18,19)15-7-2-3-8-15/h4-6,9-10H,2-3,7-8H2,1H3,(H,16,17)/b11-9+