methyl 3-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl-phenyl-amino]propanoate

Systemtic Name: methyl 3-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonyl-phenyl-amino]propanoate Openeye Name: methyl 3-[N-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]anilino]propanoate CAS Name: 3-[N-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]anilino]propanoic acid methyl ester IUPAC Name: methyl 3-[N-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonyl]anilino]propanoate Traditional Name: 3-[N-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonyl]anilino]propionic acid methyl ester Formula: C17H16N2O6S MolecularWeight: 376.38374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

COC(=O)CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C17H16N2O6S/c1-24-16(20)9-10-19(12-5-3-2-4-6-12)26(22,23)13-7-8-14-15(11-13)25-17(21)18-14/h2-8,11H,9-10H2,1H3,(H,18,21)