6,7,8,9-tetrahydrodibenzofuran-2-yl 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 6,7,8,9-tetrahydrodibenzofuran-2-yl 1-(3-ethanoylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 6,7,8,9-tetrahydrodibenzofuran-2-yl 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(3-acetylphenyl)sulfonyl-4-piperidinecarboxylic acid 6,7,8,9-tetrahydrodibenzofuran-2-yl ester IUPAC Name: 6,7,8,9-tetrahydrodibenzofuran-2-yl 1-(3-acetylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(3-acetylphenyl)sulfonylisonipecotic acid 6,7,8,9-tetrahydrodibenzofuran-2-yl ester Formula: C26H27NO6S MolecularWeight: 481.56068

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC4=C(C=C3)OC5=C4CCCC5

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)OC3=CC4=C(C=C3)OC5=C4CCCC5

InChI

InChI=1S/C26H27NO6S/c1-17(28)19-5-4-6-21(15-19)34(30,31)27-13-11-18(12-14-27)26(29)32-20-9-10-25-23(16-20)22-7-2-3-8-24(22)33-25/h4-6,9-10,15-16,18H,2-3,7-8,11-14H2,1H3