[2-[[2,4-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl] 5-morpholin-4-ylsulfonyl-2-oxidanyl-benzoate

Systemtic Name: [2-[[2,4-bis(bromanyl)phenyl]amino]-2-oxidanylidene-ethyl] 5-morpholin-4-ylsulfonyl-2-oxidanyl-benzoate Openeye Name: [2-(2,4-dibromoanilino)-2-oxo-ethyl] 2-hydroxy-5-morpholinosulfonyl-benzoate CAS Name: 2-hydroxy-5-(4-morpholinylsulfonyl)benzoic acid [2-(2,4-dibromoanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dibromoanilino)-2-oxoethyl] 2-hydroxy-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-hydroxy-5-morpholinosulfonyl-benzoic acid [2-(2,4-dibromoanilino)-2-keto-ethyl] ester Formula: C19H18Br2N2O7S MolecularWeight: 578.22842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)Br

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC(=O)NC3=C(C=C(C=C3)Br)Br

InChI

InChI=1S/C19H18Br2N2O7S/c20-12-1-3-16(15(21)9-12)22-18(25)11-30-19(26)14-10-13(2-4-17(14)24)31(27,28)23-5-7-29-8-6-23/h1-4,9-10,24H,5-8,11H2,(H,22,25)