methyl 3-[6-bromanylhexanoyl-(4-methoxycarbonylphenyl)amino]benzoate

Systemtic Name: methyl 3-[6-bromanylhexanoyl-(4-methoxycarbonylphenyl)amino]benzoate Openeye Name: methyl 3-[N-(6-bromohexanoyl)-4-methoxycarbonyl-anilino]benzoate CAS Name: 3-(N-(6-bromo-1-oxohexyl)-4-methoxycarbonylanilino)benzoic acid methyl ester IUPAC Name: methyl 3-[N-(6-bromohexanoyl)-4-methoxycarbonylanilino]benzoate Traditional Name: 3-[N-(6-bromohexanoyl)-4-carbomethoxy-anilino]benzoic acid methyl ester Formula: C22H24BrNO5 MolecularWeight: 462.33366

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)N(C2=CC=CC(=C2)C(=O)OC)C(=O)CCCCCBr

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N(C2=CC=CC(=C2)C(=O)OC)C(=O)CCCCCBr

InChI

InChI=1S/C22H24BrNO5/c1-28-21(26)16-10-12-18(13-11-16)24(20(25)9-4-3-5-14-23)19-8-6-7-17(15-19)22(27)29-2/h6-8,10-13,15H,3-5,9,14H2,1-2H3