methyl 6-[3-(3-bromophenyl)propanoylamino]hexanoate

Systemtic Name: methyl 6-[3-(3-bromophenyl)propanoylamino]hexanoate Openeye Name: methyl 6-[3-(3-bromophenyl)propanoylamino]hexanoate CAS Name: 6-[[3-(3-bromophenyl)-1-oxopropyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[3-(3-bromophenyl)propanoylamino]hexanoate Traditional Name: 6-[3-(3-bromophenyl)propanoylamino]hexanoic acid methyl ester Formula: C16H22BrNO3 MolecularWeight: 356.25478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)CCC1=CC(=CC=C1)Br

Isomeric SMILES

COC(=O)CCCCCNC(=O)CCC1=CC(=CC=C1)Br

InChI

InChI=1S/C16H22BrNO3/c1-21-16(20)8-3-2-4-11-18-15(19)10-9-13-6-5-7-14(17)12-13/h5-7,12H,2-4,8-11H2,1H3,(H,18,19)