[2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: [2-[(2-bromophenyl)amino]-2-oxidanylidene-ethyl] 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: [2-(2-bromoanilino)-2-oxo-ethyl] 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-(2-bromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromoanilino)-2-oxoethyl] 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid [2-(2-bromoanilino)-2-keto-ethyl] ester Formula: C18H16BrNO3S2 MolecularWeight: 438.35854

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(S1)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

C1CSC(S1)C2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C18H16BrNO3S2/c19-14-3-1-2-4-15(14)20-16(21)11-23-17(22)12-5-7-13(8-6-12)18-24-9-10-25-18/h1-8,18H,9-11H2,(H,20,21)