(3,3-dimethyl-2-oxidanylidene-butyl) 3-(thiophen-2-ylsulfonylamino)naphthalene-2-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-(thiophen-2-ylsulfonylamino)naphthalene-2-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-(2-thienylsulfonylamino)naphthalene-2-carboxylate CAS Name: 3-(thiophen-2-ylsulfonylamino)-2-naphthalenecarboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-(thiophen-2-ylsulfonylamino)naphthalene-2-carboxylate Traditional Name: 3-(2-thienylsulfonylamino)naphthalene-2-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H21NO5S2 MolecularWeight: 431.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC2=CC=CC=C2C=C1NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC2=CC=CC=C2C=C1NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H21NO5S2/c1-21(2,3)18(23)13-27-20(24)16-11-14-7-4-5-8-15(14)12-17(16)22-29(25,26)19-9-6-10-28-19/h4-12,22H,13H2,1-3H3