[4-[2-[4-[(4-bromophenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] 3-methoxybenzoate

Systemtic Name: [4-[2-[4-[(4-bromophenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] 3-methoxybenzoate Openeye Name: [4-[2-[4-(4-bromoanilino)-4-oxo-butanoyl]oxyacetyl]phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[2-[4-(4-bromoanilino)-1,4-dioxobutoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-(4-bromoanilino)-4-oxobutanoyl]oxyacetyl]phenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-[2-[4-(4-bromoanilino)-4-keto-butanoyl]oxyacetyl]phenyl] ester Formula: C26H22BrNO7 MolecularWeight: 540.35938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C26H22BrNO7/c1-33-22-4-2-3-18(15-22)26(32)35-21-11-5-17(6-12-21)23(29)16-34-25(31)14-13-24(30)28-20-9-7-19(27)8-10-20/h2-12,15H,13-14,16H2,1H3,(H,28,30)