tert-butyl 4-[4-[(7-cyanonaphthalen-2-yl)methyl-(2-ethoxy-2-oxidanylidene-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(7-cyanonaphthalen-2-yl)methyl-(2-ethoxy-2-oxidanylidene-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(7-cyano-2-naphthyl)methyl-(2-ethoxy-2-oxo-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-[(7-cyano-2-naphthalenyl)methyl-(2-ethoxy-2-oxoethyl)sulfonylamino]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(7-cyanonaphthalen-2-yl)methyl-(2-ethoxy-2-oxoethyl)sulfonylamino]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[(7-cyano-2-naphthyl)methyl-(2-ethoxy-2-keto-ethyl)sulfonyl-amino]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H37N3O7S MolecularWeight: 607.71708

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CS(=O)(=O)N(CC1=CC2=C(C=C1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)CS(=O)(=O)N(CC1=CC2=C(C=C1)C=CC(=C2)C#N)C3=CC=C(C=C3)OC4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H37N3O7S/c1-5-40-30(36)22-43(38,39)35(21-24-7-9-25-8-6-23(20-33)18-26(25)19-24)27-10-12-28(13-11-27)41-29-14-16-34(17-15-29)31(37)42-32(2,3)4/h6-13,18-19,29H,5,14-17,21-22H2,1-4H3