2-[(2-chlorophenyl)carbonylamino]-3-(2-oxidanylidene-3H-1,3-benzoxazol-5-yl)propanoic acid

Systemtic Name: 2-[(2-chlorophenyl)carbonylamino]-3-(2-oxidanylidene-3H-1,3-benzoxazol-5-yl)propanoic acid Openeye Name: 2-[(2-chlorobenzoyl)amino]-3-(2-oxo-3H-1,3-benzoxazol-5-yl)propanoic acid CAS Name: 2-[[(2-chlorophenyl)-oxomethyl]amino]-3-(2-oxo-3H-1,3-benzoxazol-5-yl)propanoic acid IUPAC Name: 2-[(2-chlorobenzoyl)amino]-3-(2-oxo-3H-1,3-benzoxazol-5-yl)propanoic acid Traditional Name: 2-[(2-chlorobenzoyl)amino]-3-(2-keto-3H-1,3-benzoxazol-5-yl)propionic acid Formula: C17H13ClN2O5 MolecularWeight: 360.74852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(CC2=CC3=C(C=C2)OC(=O)N3)C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(CC2=CC3=C(C=C2)OC(=O)N3)C(=O)O)Cl

InChI

InChI=1S/C17H13ClN2O5/c18-11-4-2-1-3-10(11)15(21)19-13(16(22)23)8-9-5-6-14-12(7-9)20-17(24)25-14/h1-7,13H,8H2,(H,19,21)(H,20,24)(H,22,23)