(E)-3-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]prop-2-enoic acid Openeye Name: (E)-3-(1-benzylsulfonylpyrrolidin-2-yl)prop-2-enoic acid CAS Name: (E)-3-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]-2-propenoic acid IUPAC Name: (E)-3-(1-benzylsulfonylpyrrolidin-2-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-benzylsulfonylpyrrolidin-2-yl)acrylic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C=CC(=O)O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)/C=C/C(=O)O

InChI

InChI=1S/C14H17NO4S/c16-14(17)9-8-13-7-4-10-15(13)20(18,19)11-12-5-2-1-3-6-12/h1-3,5-6,8-9,13H,4,7,10-11H2,(H,16,17)/b9-8+