[2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 5-[(4-bromophenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: [2-(4-nitrophenyl)-2-oxidanylidene-ethyl] 5-[(4-bromophenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: [2-(4-nitrophenyl)-2-oxo-ethyl] 5-(4-bromoanilino)-5-oxo-pentanoate CAS Name: 5-(4-bromoanilino)-5-oxopentanoic acid [2-(4-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-nitrophenyl)-2-oxoethyl] 5-(4-bromoanilino)-5-oxopentanoate Traditional Name: 5-(4-bromoanilino)-5-keto-valeric acid [2-keto-2-(4-nitrophenyl)ethyl] ester Formula: C19H17BrN2O6 MolecularWeight: 449.25208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)COC(=O)CCCC(=O)NC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H17BrN2O6/c20-14-6-8-15(9-7-14)21-18(24)2-1-3-19(25)28-12-17(23)13-4-10-16(11-5-13)22(26)27/h4-11H,1-3,12H2,(H,21,24)