tert-butyl 2-[3-[2-(ethylsulfonylamino)phenyl]cyclohexa-2,4-dien-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[3-[2-(ethylsulfonylamino)phenyl]cyclohexa-2,4-dien-1-yl]ethanoate Openeye Name: tert-butyl 2-[3-[2-(ethylsulfonylamino)phenyl]cyclohexa-2,4-dien-1-yl]acetate CAS Name: 2-[3-[2-(ethylsulfonylamino)phenyl]-1-cyclohexa-2,4-dienyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[2-(ethylsulfonylamino)phenyl]cyclohexa-2,4-dien-1-yl]acetate Traditional Name: 2-[3-[2-(esylamino)phenyl]cyclohexa-2,4-dien-1-yl]acetic acid tert-butyl ester Formula: C20H27NO4S MolecularWeight: 377.49768

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC=CC=C1C2=CC(CC=C2)CC(=O)OC(C)(C)C

Isomeric SMILES

CCS(=O)(=O)NC1=CC=CC=C1C2=CC(CC=C2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C20H27NO4S/c1-5-26(23,24)21-18-12-7-6-11-17(18)16-10-8-9-15(13-16)14-19(22)25-20(2,3)4/h6-8,10-13,15,21H,5,9,14H2,1-4H3