2-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[(3-keto-4H-1,4-benzoxazin-6-yl)sulfonylamino]-3-phenyl-propionic acid Formula: C17H16N2O6S MolecularWeight: 376.38374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H16N2O6S/c20-16-10-25-15-7-6-12(9-13(15)18-16)26(23,24)19-14(17(21)22)8-11-4-2-1-3-5-11/h1-7,9,14,19H,8,10H2,(H,18,20)(H,21,22)