(E)-3-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)prop-2-enoic acid CAS Name: (E)-3-[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(4-methyl-3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-methyl-3-pyrrolidinosulfonyl-phenyl)acrylic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO4S/c1-11-4-5-12(6-7-14(16)17)10-13(11)20(18,19)15-8-2-3-9-15/h4-7,10H,2-3,8-9H2,1H3,(H,16,17)/b7-6+