(4-acetamidonaphthalen-1-yl) 2,5-diethylbenzenesulfonate

Systemtic Name: (4-acetamidonaphthalen-1-yl) 2,5-diethylbenzenesulfonate Openeye Name: (4-acetamido-1-naphthyl) 2,5-diethylbenzenesulfonate CAS Name: 2,5-diethylbenzenesulfonic acid (4-acetamido-1-naphthalenyl) ester IUPAC Name: (4-acetamidonaphthalen-1-yl) 2,5-diethylbenzenesulfonate Traditional Name: 2,5-diethylbenzenesulfonic acid (4-acetamido-1-naphthyl) ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)S(=O)(=O)OC2=CC=C(C3=CC=CC=C32)NC(=O)C

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)S(=O)(=O)OC2=CC=C(C3=CC=CC=C32)NC(=O)C

InChI

InChI=1S/C22H23NO4S/c1-4-16-10-11-17(5-2)22(14-16)28(25,26)27-21-13-12-20(23-15(3)24)18-8-6-7-9-19(18)21/h6-14H,4-5H2,1-3H3,(H,23,24)