(E)-3-(4-piperidin-1-ylsulfonylphenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-piperidin-1-ylsulfonylphenyl)prop-2-enoic acid Openeye Name: (E)-3-[4-(1-piperidylsulfonyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(1-piperidinylsulfonyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(4-piperidin-1-ylsulfonylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-piperidinosulfonylphenyl)acrylic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C=CC(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)O

InChI

InChI=1S/C14H17NO4S/c16-14(17)9-6-12-4-7-13(8-5-12)20(18,19)15-10-2-1-3-11-15/h4-9H,1-3,10-11H2,(H,16,17)/b9-6+