N-(5-oxaldehydoyl-2-phenylmethoxy-phenyl)methanesulfonamide hydrate

Systemtic Name: N-(5-oxaldehydoyl-2-phenylmethoxy-phenyl)methanesulfonamide hydrate Openeye Name: N-(2-benzyloxy-5-oxaldehydoyl-phenyl)methanesulfonamide hydrate CAS Name: N-(5-oxaldehydoyl-2-phenylmethoxyphenyl)methanesulfonamide hydrate IUPAC Name: N-(5-oxaldehydoyl-2-phenylmethoxyphenyl)methanesulfonamide hydrate Traditional Name: N-(2-benzoxy-5-glyoxyloyl-phenyl)methanesulfonamide hydrate Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=C(C=CC(=C1)C(=O)C=O)OCC2=CC=CC=C2.O

Isomeric SMILES

CS(=O)(=O)NC1=C(C=CC(=C1)C(=O)C=O)OCC2=CC=CC=C2.O

InChI

InChI=1S/C16H15NO5S.H2O/c1-23(20,21)17-14-9-13(15(19)10-18)7-8-16(14)22-11-12-5-3-2-4-6-12;/h2-10,17H,11H2,1H3;1H2