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

Systemtic Name: (E)-3-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)prop-2-enoic acid Openeye Name: (E)-3-[4-methyl-3-(1-piperidylsulfonyl)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-propenoic acid IUPAC Name: (E)-3-(4-methyl-3-piperidin-1-ylsulfonylphenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-methyl-3-piperidinosulfonyl-phenyl)acrylic acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C=CC(=O)O)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)/C=C/C(=O)O)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C15H19NO4S/c1-12-5-6-13(7-8-15(17)18)11-14(12)21(19,20)16-9-3-2-4-10-16/h5-8,11H,2-4,9-10H2,1H3,(H,17,18)/b8-7+