(E)-3-[4-(azetidin-1-ylsulfonyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(azetidin-1-ylsulfonyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(azetidin-1-ylsulfonyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(1-azetidinylsulfonyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(azetidin-1-ylsulfonyl)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(azetidin-1-ylsulfonyl)phenyl]acrylic acid Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C1)S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

C1CN(C1)S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C12H13NO4S/c14-12(15)7-4-10-2-5-11(6-3-10)18(16,17)13-8-1-9-13/h2-7H,1,8-9H2,(H,14,15)/b7-4+