3-[4-[[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]sulfonylamino]phenyl]propanoate

Systemtic Name: 3-[4-[[(2R)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]sulfonylamino]phenyl]propanoate Openeye Name: 3-[4-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]sulfonylamino]phenyl]propanoate CAS Name: 3-[4-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]sulfonylamino]phenyl]propanoate IUPAC Name: 3-[4-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]sulfonylamino]phenyl]propanoate Traditional Name: 3-[4-[[(2R)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]sulfonylamino]phenyl]propionate Formula: C18H17N2O6S- MolecularWeight: 389.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)CCC(=O)[O-]

Isomeric SMILES

C[C@@H]1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=C(C=C3)CCC(=O)[O-]

InChI

InChI=1S/C18H18N2O6S/c1-11-18(23)19-15-10-14(7-8-16(15)26-11)27(24,25)20-13-5-2-12(3-6-13)4-9-17(21)22/h2-3,5-8,10-11,20H,4,9H2,1H3,(H,19,23)(H,21,22)/p-1/t11-/m1/s1