2-[3-oxidanylidene-6-[3-oxidanylidene-3-phenylmethoxy-2-(phenylsulfonylamino)propyl]-4H-1,4-benzoxazin-2-yl]ethanoic acid

Systemtic Name: 2-[3-oxidanylidene-6-[3-oxidanylidene-3-phenylmethoxy-2-(phenylsulfonylamino)propyl]-4H-1,4-benzoxazin-2-yl]ethanoic acid Openeye Name: 2-[6-[2-(benzenesulfonamido)-3-benzyloxy-3-oxo-propyl]-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid CAS Name: 2-[6-[2-(benzenesulfonamido)-3-oxo-3-phenylmethoxypropyl]-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid IUPAC Name: 2-[6-[2-(benzenesulfonamido)-3-oxo-3-phenylmethoxypropyl]-3-oxo-4H-1,4-benzoxazin-2-yl]acetic acid Traditional Name: 2-[6-[2-(benzenesulfonamido)-3-benzoxy-3-keto-propyl]-3-keto-4H-1,4-benzoxazin-2-yl]acetic acid Formula: C26H24N2O8S MolecularWeight: 524.54236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CC3=C(C=C2)OC(C(=O)N3)CC(=O)O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CC3=C(C=C2)OC(C(=O)N3)CC(=O)O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H24N2O8S/c29-24(30)15-23-25(31)27-20-13-18(11-12-22(20)36-23)14-21(26(32)35-16-17-7-3-1-4-8-17)28-37(33,34)19-9-5-2-6-10-19/h1-13,21,23,28H,14-16H2,(H,27,31)(H,29,30)