N-tert-butyl-1-[[3-methyl-5-[(E)-2-(4-methylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxamide

Systemtic Name: N-tert-butyl-1-[[3-methyl-5-[(E)-2-(4-methylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxamide Openeye Name: N-tert-butyl-1-[3-methyl-5-[(E)-2-(p-tolyl)vinyl]isoxazol-4-yl]sulfonyl-piperidine-3-carboxamide CAS Name: N-tert-butyl-1-[[3-methyl-5-[(E)-2-(4-methylphenyl)ethenyl]-4-isoxazolyl]sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-tert-butyl-1-[[3-methyl-5-[(E)-2-(4-methylphenyl)ethenyl]-1,2-oxazol-4-yl]sulfonyl]piperidine-3-carboxamide Traditional Name: N-tert-butyl-1-[3-methyl-5-[(E)-2-(p-tolyl)vinyl]isoxazol-4-yl]sulfonyl-nipecotamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC2=C(C(=NO2)C)S(=O)(=O)N3CCCC(C3)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C2=C(C(=NO2)C)S(=O)(=O)N3CCCC(C3)C(=O)NC(C)(C)C

InChI

InChI=1S/C23H31N3O4S/c1-16-8-10-18(11-9-16)12-13-20-21(17(2)25-30-20)31(28,29)26-14-6-7-19(15-26)22(27)24-23(3,4)5/h8-13,19H,6-7,14-15H2,1-5H3,(H,24,27)/b13-12+