1-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[[3-(1,3-benzoxazol-2-yl)-1-piperidyl]sulfonyl]phenyl]ethanone CAS Name: 1-[3-[[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[3-(1,3-benzoxazol-2-yl)piperidino]sulfonylphenyl]ethanone Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC(C2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H20N2O4S/c1-14(23)15-6-4-8-17(12-15)27(24,25)22-11-5-7-16(13-22)20-21-18-9-2-3-10-19(18)26-20/h2-4,6,8-10,12,16H,5,7,11,13H2,1H3