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

Systemtic Name: (2R)-2-[(2-oxidanylidene-3H-1,3-benzoxazol-6-yl)sulfonylamino]-3-phenyl-propanoate Openeye Name: (2R)-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]-3-phenyl-propanoate CAS Name: (2R)-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]-3-phenylpropanoate IUPAC Name: (2R)-2-[(2-oxo-3H-1,3-benzoxazol-6-yl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R)-2-[(2-keto-3H-1,3-benzoxazol-6-yl)sulfonylamino]-3-phenyl-propionate Formula: C16H13N2O6S- MolecularWeight: 361.34922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)[O-])NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)[O-])NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C16H14N2O6S/c19-15(20)13(8-10-4-2-1-3-5-10)18-25(22,23)11-6-7-12-14(9-11)24-16(21)17-12/h1-7,9,13,18H,8H2,(H,17,21)(H,19,20)/p-1/t13-/m1/s1