(2S)-5-azanyl-5-oxidanylidene-2-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]pentanoate

Systemtic Name: (2S)-5-azanyl-5-oxidanylidene-2-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]pentanoate Openeye Name: (2S)-5-amino-5-oxo-2-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]pentanoate CAS Name: (2S)-5-amino-5-oxo-2-[[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]amino]pentanoate IUPAC Name: (2S)-5-amino-5-oxo-2-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]pentanoate Traditional Name: (2S)-5-amino-5-keto-2-[(3-phenylanthranil-5-carbonyl)amino]valerate Formula: C19H16N3O5- MolecularWeight: 366.34744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NC(CCC(=O)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)N[C@@H](CCC(=O)N)C(=O)[O-]

InChI

InChI=1S/C19H17N3O5/c20-16(23)9-8-15(19(25)26)21-18(24)12-6-7-14-13(10-12)17(27-22-14)11-4-2-1-3-5-11/h1-7,10,15H,8-9H2,(H2,20,23)(H,21,24)(H,25,26)/p-1/t15-/m0/s1