1-[[3-methyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxylate

Systemtic Name: 1-[[3-methyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxylate Openeye Name: 1-[3-methyl-5-[2-(2-thienyl)vinyl]isoxazol-4-yl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[[3-methyl-5-(2-thiophen-2-ylethenyl)-4-isoxazolyl]sulfonyl]-3-piperidinecarboxylate IUPAC Name: 1-[[3-methyl-5-(2-thiophen-2-ylethenyl)-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxylate Traditional Name: 1-[3-methyl-5-[2-(2-thienyl)vinyl]isoxazol-4-yl]sulfonylnipecotate Formula: C16H17N2O5S2- MolecularWeight: 381.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1S(=O)(=O)N2CCCC(C2)C(=O)[O-])C=CC3=CC=CS3

Isomeric SMILES

CC1=NOC(=C1S(=O)(=O)N2CCCC(C2)C(=O)[O-])C=CC3=CC=CS3

InChI

InChI=1S/C16H18N2O5S2/c1-11-15(14(23-17-11)7-6-13-5-3-9-24-13)25(21,22)18-8-2-4-12(10-18)16(19)20/h3,5-7,9,12H,2,4,8,10H2,1H3,(H,19,20)/p-1