3-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]propanoate

Systemtic Name: 3-[(3-phenyl-2,1-benzoxazol-5-yl)carbonylamino]propanoate Openeye Name: 3-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]propanoate CAS Name: 3-[[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]amino]propanoate IUPAC Name: 3-[(3-phenyl-2,1-benzoxazole-5-carbonyl)amino]propanoate Traditional Name: 3-[(3-phenylanthranil-5-carbonyl)amino]propionate Formula: C17H13N2O4- MolecularWeight: 309.29612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NCCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NCCC(=O)[O-]

InChI

InChI=1S/C17H14N2O4/c20-15(21)8-9-18-17(22)12-6-7-14-13(10-12)16(23-19-14)11-4-2-1-3-5-11/h1-7,10H,8-9H2,(H,18,22)(H,20,21)/p-1