(2S)-2-[(3-oxidanyl-2-oxidanylidene-chromen-6-yl)sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(3-oxidanyl-2-oxidanylidene-chromen-6-yl)sulfonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[(3-hydroxy-2-oxo-chromen-6-yl)sulfonylamino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[(3-hydroxy-2-oxo-1-benzopyran-6-yl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(3-hydroxy-2-oxochromen-6-yl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[(3-hydroxy-2-keto-chromen-6-yl)sulfonylamino]-3-phenyl-propionic acid Formula: C18H15NO7S MolecularWeight: 389.3792

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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)OC(=O)C(=C3)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)OC(=O)C(=C3)O

InChI

InChI=1S/C18H15NO7S/c20-15-10-12-9-13(6-7-16(12)26-18(15)23)27(24,25)19-14(17(21)22)8-11-4-2-1-3-5-11/h1-7,9-10,14,19-20H,8H2,(H,21,22)/t14-/m0/s1