piperidin-1-ylsulfonyl 4-[4-[3-(2,2-diethoxyethoxy)phenyl]-3-methyl-phenyl]oxane-4-carboxylate

Systemtic Name: piperidin-1-ylsulfonyl 4-[4-[3-(2,2-diethoxyethoxy)phenyl]-3-methyl-phenyl]oxane-4-carboxylate Openeye Name: 1-piperidylsulfonyl 4-[4-[3-(2,2-diethoxyethoxy)phenyl]-3-methyl-phenyl]tetrahydropyran-4-carboxylate CAS Name: 4-[4-[3-(2,2-diethoxyethoxy)phenyl]-3-methylphenyl]-4-oxanecarboxylic acid 1-piperidinylsulfonyl ester IUPAC Name: piperidin-1-ylsulfonyl 4-[4-[3-(2,2-diethoxyethoxy)phenyl]-3-methylphenyl]oxane-4-carboxylate Traditional Name: 4-[4-[3-(2,2-diethoxyethoxy)phenyl]-3-methyl-phenyl]tetrahydropyran-4-carboxylic acid piperidinosulfonyl ester Formula: C30H41NO8S MolecularWeight: 575.71344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(COC1=CC=CC(=C1)C2=C(C=C(C=C2)C3(CCOCC3)C(=O)OS(=O)(=O)N4CCCCC4)C)OCC

Isomeric SMILES

CCOC(COC1=CC=CC(=C1)C2=C(C=C(C=C2)C3(CCOCC3)C(=O)OS(=O)(=O)N4CCCCC4)C)OCC

InChI

InChI=1S/C30H41NO8S/c1-4-36-28(37-5-2)22-38-26-11-9-10-24(21-26)27-13-12-25(20-23(27)3)30(14-18-35-19-15-30)29(32)39-40(33,34)31-16-7-6-8-17-31/h9-13,20-21,28H,4-8,14-19,22H2,1-3H3