2-[(4-bromanylnaphthalen-1-yl)sulfonyl-ethyl-amino]benzoate

Systemtic Name: 2-[(4-bromanylnaphthalen-1-yl)sulfonyl-ethyl-amino]benzoate Openeye Name: 2-[(4-bromo-1-naphthyl)sulfonyl-ethyl-amino]benzoate CAS Name: 2-[(4-bromo-1-naphthalenyl)sulfonyl-ethylamino]benzoate IUPAC Name: 2-[(4-bromonaphthalen-1-yl)sulfonyl-ethylamino]benzoate Traditional Name: 2-[(4-bromo-1-naphthyl)sulfonyl-ethyl-amino]benzoate Formula: C19H15BrNO4S- MolecularWeight: 433.2957

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrNO4S/c1-2-21(17-10-6-5-9-15(17)19(22)23)26(24,25)18-12-11-16(20)13-7-3-4-8-14(13)18/h3-12H,2H2,1H3,(H,22,23)/p-1