[4-[2-(5-oxidanylidene-5-phenylazanyl-pentanoyl)oxyethanoyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[2-(5-oxidanylidene-5-phenylazanyl-pentanoyl)oxyethanoyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-[2-(5-anilino-5-oxo-pentanoyl)oxyacetyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[2-(5-anilino-1,5-dioxopentoxy)-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-(5-anilino-5-oxopentanoyl)oxyacetyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[2-(5-anilino-5-keto-pentanoyl)oxyacetyl]phenyl] ester Formula: C26H22BrNO6 MolecularWeight: 524.35998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C26H22BrNO6/c27-20-13-9-19(10-14-20)26(32)34-22-15-11-18(12-16-22)23(29)17-33-25(31)8-4-7-24(30)28-21-5-2-1-3-6-21/h1-3,5-6,9-16H,4,7-8,17H2,(H,28,30)