dibenzofuran-2-yl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: dibenzofuran-2-yl 2-methyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: dibenzofuran-2-yl 2-methyl-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-methyl-5-(1-piperidinylsulfonyl)benzoic acid 2-dibenzofuranyl ester IUPAC Name: dibenzofuran-2-yl 2-methyl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-methyl-5-piperidinosulfonyl-benzoic acid dibenzofuran-2-yl ester Formula: C25H23NO5S MolecularWeight: 449.51882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC3=CC4=C(C=C3)OC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)OC3=CC4=C(C=C3)OC5=CC=CC=C54

InChI

InChI=1S/C25H23NO5S/c1-17-9-11-19(32(28,29)26-13-5-2-6-14-26)16-21(17)25(27)30-18-10-12-24-22(15-18)20-7-3-4-8-23(20)31-24/h3-4,7-12,15-16H,2,5-6,13-14H2,1H3