tert-butyl 4-[2-chloranyl-4-[[(E)-3-[5-cyano-2-(methoxymethoxy)phenyl]prop-2-enyl]-(2-ethoxy-2-oxidanylidene-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-chloranyl-4-[[(E)-3-[5-cyano-2-(methoxymethoxy)phenyl]prop-2-enyl]-(2-ethoxy-2-oxidanylidene-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-chloro-4-[[(E)-3-[5-cyano-2-(methoxymethoxy)phenyl]allyl]-(2-ethoxy-2-oxo-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylate CAS Name: 4-[2-chloro-4-[[(E)-3-[5-cyano-2-(methoxymethoxy)phenyl]prop-2-enyl]-(2-ethoxy-2-oxoethyl)sulfonylamino]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-chloro-4-[[(E)-3-[5-cyano-2-(methoxymethoxy)phenyl]prop-2-enyl]-(2-ethoxy-2-oxoethyl)sulfonylamino]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[2-chloro-4-[[(E)-3-[5-cyano-2-(methoxymethoxy)phenyl]allyl]-(2-ethoxy-2-keto-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H40ClN3O9S MolecularWeight: 678.1927

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)N(CC=CC1=C(C=CC(=C1)C#N)OCOC)C2=CC(=C(C=C2)OC3CCN(CC3)C(=O)OC(C)(C)C)Cl

Isomeric SMILES

CCOC(=O)CS(=O)(=O)N(C/C=C/C1=C(C=CC(=C1)C#N)OCOC)C2=CC(=C(C=C2)OC3CCN(CC3)C(=O)OC(C)(C)C)Cl

InChI

InChI=1S/C32H40ClN3O9S/c1-6-42-30(37)21-46(39,40)36(15-7-8-24-18-23(20-34)9-11-28(24)43-22-41-5)25-10-12-29(27(33)19-25)44-26-13-16-35(17-14-26)31(38)45-32(2,3)4/h7-12,18-19,26H,6,13-17,21-22H2,1-5H3/b8-7+