[2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-bromophenyl)carbonylamino]propanoate

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] (2S)-2-[(4-bromophenyl)carbonylamino]propanoate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] (2S)-2-[(4-bromobenzoyl)amino]propanoate CAS Name: (2S)-2-[[(4-bromophenyl)-oxomethyl]amino]propanoic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] (2S)-2-[(4-bromobenzoyl)amino]propanoate Traditional Name: (2S)-2-[(4-bromobenzoyl)amino]propionic acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H18BrN3O5 MolecularWeight: 400.22452

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCNC(=O)NC(=O)COC(=O)[C@H](C)NC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C15H18BrN3O5/c1-3-17-15(23)19-12(20)8-24-14(22)9(2)18-13(21)10-4-6-11(16)7-5-10/h4-7,9H,3,8H2,1-2H3,(H,18,21)(H2,17,19,20,23)/t9-/m0/s1