1-[[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-methyl-5-[(E)-styryl]isoxazol-4-yl]sulfonylpiperidine-3-carboxylic acid CAS Name: 1-[[3-methyl-5-[(E)-2-phenylethenyl]-4-isoxazolyl]sulfonyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-methyl-5-[(E)-styryl]isoxazol-4-yl]sulfonylnipecotic acid Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1S(=O)(=O)N2CCCC(C2)C(=O)O)C=CC3=CC=CC=C3

Isomeric SMILES

CC1=NOC(=C1S(=O)(=O)N2CCCC(C2)C(=O)O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O5S/c1-13-17(16(25-19-13)10-9-14-6-3-2-4-7-14)26(23,24)20-11-5-8-15(12-20)18(21)22/h2-4,6-7,9-10,15H,5,8,11-12H2,1H3,(H,21,22)/b10-9+