piperidin-1-ylsulfonyl 4-[4-(3-hydroxyphenyl)-3-methyl-phenyl]oxane-4-carboxylate

Systemtic Name: piperidin-1-ylsulfonyl 4-[4-(3-hydroxyphenyl)-3-methyl-phenyl]oxane-4-carboxylate Openeye Name: 1-piperidylsulfonyl 4-[4-(3-hydroxyphenyl)-3-methyl-phenyl]tetrahydropyran-4-carboxylate CAS Name: 4-[4-(3-hydroxyphenyl)-3-methylphenyl]-4-oxanecarboxylic acid 1-piperidinylsulfonyl ester IUPAC Name: piperidin-1-ylsulfonyl 4-[4-(3-hydroxyphenyl)-3-methylphenyl]oxane-4-carboxylate Traditional Name: 4-[4-(3-hydroxyphenyl)-3-methyl-phenyl]tetrahydropyran-4-carboxylic acid piperidinosulfonyl ester Formula: C24H29NO6S MolecularWeight: 459.55516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2(CCOCC2)C(=O)OS(=O)(=O)N3CCCCC3)C4=CC(=CC=C4)O

Isomeric SMILES

CC1=C(C=CC(=C1)C2(CCOCC2)C(=O)OS(=O)(=O)N3CCCCC3)C4=CC(=CC=C4)O

InChI

InChI=1S/C24H29NO6S/c1-18-16-20(8-9-22(18)19-6-5-7-21(26)17-19)24(10-14-30-15-11-24)23(27)31-32(28,29)25-12-3-2-4-13-25/h5-9,16-17,26H,2-4,10-15H2,1H3