methyl 6-[[1-(4-bromophenyl)carbonylpiperidin-4-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[1-(4-bromophenyl)carbonylpiperidin-4-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[1-(4-bromobenzoyl)piperidine-4-carbonyl]amino]hexanoate CAS Name: 6-[[[1-[(4-bromophenyl)-oxomethyl]-4-piperidinyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[1-(4-bromobenzoyl)piperidine-4-carbonyl]amino]hexanoate Traditional Name: 6-[[1-(4-bromobenzoyl)isonipecotoyl]amino]hexanoic acid methyl ester Formula: C20H27BrN2O4 MolecularWeight: 439.34338

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)C1CCN(CC1)C(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H27BrN2O4/c1-27-18(24)5-3-2-4-12-22-19(25)15-10-13-23(14-11-15)20(26)16-6-8-17(21)9-7-16/h6-9,15H,2-5,10-14H2,1H3,(H,22,25)