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

Systemtic Name: methyl 3-[6-bromanylhexanoyl-[(4-methoxycarbonylphenyl)methyl]amino]benzoate Openeye Name: methyl 3-[6-bromohexanoyl-[(4-methoxycarbonylphenyl)methyl]amino]benzoate CAS Name: 3-[(6-bromo-1-oxohexyl)-[(4-methoxycarbonylphenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[6-bromohexanoyl-[(4-methoxycarbonylphenyl)methyl]amino]benzoate Traditional Name: 3-[6-bromohexanoyl-(4-carbomethoxybenzyl)amino]benzoic acid methyl ester Formula: C23H26BrNO5 MolecularWeight: 476.36024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26BrNO5/c1-29-22(27)18-12-10-17(11-13-18)16-25(21(26)9-4-3-5-14-24)20-8-6-7-19(15-20)23(28)30-2/h6-8,10-13,15H,3-5,9,14,16H2,1-2H3