[2-oxidanylidene-2-(pentylamino)ethyl] 3-[(4-bromophenyl)carbonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 3-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: [2-oxo-2-(pentylamino)ethyl] 3-[(4-bromobenzoyl)amino]propanoate CAS Name: 3-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid [2-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 3-[(4-bromobenzoyl)amino]propanoate Traditional Name: 3-[(4-bromobenzoyl)amino]propionic acid [2-(amylamino)-2-keto-ethyl] ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)COC(=O)CCNC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCNC(=O)COC(=O)CCNC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H23BrN2O4/c1-2-3-4-10-19-15(21)12-24-16(22)9-11-20-17(23)13-5-7-14(18)8-6-13/h5-8H,2-4,9-12H2,1H3,(H,19,21)(H,20,23)