[2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 4-[(4-bromophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-(4-phenylmethoxyphenyl)ethyl] 4-[(4-bromophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(4-benzyloxyphenyl)-2-oxo-ethyl] 4-(4-bromoanilino)-4-oxo-butanoate CAS Name: 4-(4-bromoanilino)-4-oxobutanoic acid [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenylmethoxyphenyl)ethyl] 4-(4-bromoanilino)-4-oxobutanoate Traditional Name: 4-(4-bromoanilino)-4-keto-butyric acid [2-(4-benzoxyphenyl)-2-keto-ethyl] ester Formula: C25H22BrNO5 MolecularWeight: 496.34988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C25H22BrNO5/c26-20-8-10-21(11-9-20)27-24(29)14-15-25(30)32-17-23(28)19-6-12-22(13-7-19)31-16-18-4-2-1-3-5-18/h1-13H,14-17H2,(H,27,29)