2-(1,3-benzothiazol-2-yl)-5-[(5-bromanyl-2-chloranyl-phenyl)carbonylamino]phenolate

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-bromanyl-2-chloranyl-phenyl)carbonylamino]phenolate Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-bromo-2-chloro-benzoyl)amino]phenolate CAS Name: 2-(1,3-benzothiazol-2-yl)-5-[[(5-bromo-2-chlorophenyl)-oxomethyl]amino]phenolate IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-bromo-2-chlorobenzoyl)amino]phenolate Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-[(5-bromo-2-chloro-benzoyl)amino]phenolate Formula: C20H11BrClN2O2S- MolecularWeight: 458.73554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)NC(=O)C4=C(C=CC(=C4)Br)Cl)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=C(C=C(C=C3)NC(=O)C4=C(C=CC(=C4)Br)Cl)[O-]

InChI

InChI=1S/C20H12BrClN2O2S/c21-11-5-8-15(22)14(9-11)19(26)23-12-6-7-13(17(25)10-12)20-24-16-3-1-2-4-18(16)27-20/h1-10,25H,(H,23,26)/p-1