2-[butyl-(4-methylnaphthalen-1-yl)sulfonyl-amino]benzoate

Systemtic Name: 2-[butyl-(4-methylnaphthalen-1-yl)sulfonyl-amino]benzoate Openeye Name: 2-[butyl-[(4-methyl-1-naphthyl)sulfonyl]amino]benzoate CAS Name: 2-[butyl-[(4-methyl-1-naphthalenyl)sulfonyl]amino]benzoate IUPAC Name: 2-[butyl-(4-methylnaphthalen-1-yl)sulfonylamino]benzoate Traditional Name: 2-[butyl-[(4-methyl-1-naphthyl)sulfonyl]amino]benzoate Formula: C22H22NO4S- MolecularWeight: 396.47938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1C(=O)[O-])S(=O)(=O)C2=CC=C(C3=CC=CC=C32)C

Isomeric SMILES

CCCCN(C1=CC=CC=C1C(=O)[O-])S(=O)(=O)C2=CC=C(C3=CC=CC=C32)C

InChI

InChI=1S/C22H23NO4S/c1-3-4-15-23(20-12-8-7-11-19(20)22(24)25)28(26,27)21-14-13-16(2)17-9-5-6-10-18(17)21/h5-14H,3-4,15H2,1-2H3,(H,24,25)/p-1