[2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]phenyl] 2-bromanylbenzoate

Systemtic Name: [2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]phenyl] 2-bromanylbenzoate Openeye Name: [2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenyl] ester IUPAC Name: [2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]phenyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]phenyl] ester Formula: C20H13BrN2O4S MolecularWeight: 457.29722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC=CC=C3OC(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NC3=CC=CC=C3OC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C20H13BrN2O4S/c21-15-9-3-1-7-13(15)20(24)27-17-11-5-4-10-16(17)22-19-14-8-2-6-12-18(14)28(25,26)23-19/h1-12H,(H,22,23)