(2S)-5-[(4-bromophenyl)carbonylamino]-5-oxidanylidene-2-[(phenylmethyl)amino]pentanoic acid

Systemtic Name: (2S)-5-[(4-bromophenyl)carbonylamino]-5-oxidanylidene-2-[(phenylmethyl)amino]pentanoic acid Openeye Name: (2S)-2-(benzylamino)-5-[(4-bromobenzoyl)amino]-5-oxo-pentanoic acid CAS Name: (2S)-5-[[(4-bromophenyl)-oxomethyl]amino]-5-oxo-2-[(phenylmethyl)amino]pentanoic acid IUPAC Name: (2S)-2-(benzylamino)-5-[(4-bromobenzoyl)amino]-5-oxopentanoic acid Traditional Name: (2S)-2-(benzylamino)-5-[(4-bromobenzoyl)amino]-5-keto-valeric acid Formula: C19H19BrN2O4 MolecularWeight: 419.26916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(CCC(=O)NC(=O)C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN[C@@H](CCC(=O)NC(=O)C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C19H19BrN2O4/c20-15-8-6-14(7-9-15)18(24)22-17(23)11-10-16(19(25)26)21-12-13-4-2-1-3-5-13/h1-9,16,21H,10-12H2,(H,25,26)(H,22,23,24)/t16-/m0/s1