O1-tert-butyl O4-ethyl 4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-ethyl 4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-ethyl 4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1,4-dicarboxylate CAS Name: 4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1,4-dicarboxylate Traditional Name: 4-[(4-phenoxyphenyl)sulfonylmethyl]piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-ethyl ester Formula: C26H33NO7S MolecularWeight: 503.60772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)CS(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H33NO7S/c1-5-32-23(28)26(15-17-27(18-16-26)24(29)34-25(2,3)4)19-35(30,31)22-13-11-21(12-14-22)33-20-9-7-6-8-10-20/h6-14H,5,15-19H2,1-4H3