N-[4-oxidanylidene-6-phenoxy-7-(sulfamoylmethyl)chromen-3-yl]methanamide hydrate

Systemtic Name: N-[4-oxidanylidene-6-phenoxy-7-(sulfamoylmethyl)chromen-3-yl]methanamide hydrate Openeye Name: N-[4-oxo-6-phenoxy-7-(sulfamoylmethyl)chromen-3-yl]formamide hydrate CAS Name: N-[4-oxo-6-phenoxy-7-(sulfamoylmethyl)-1-benzopyran-3-yl]formamide hydrate IUPAC Name: N-[4-oxo-6-phenoxy-7-(sulfamoylmethyl)chromen-3-yl]formamide hydrate Traditional Name: N-[4-keto-6-phenoxy-7-(sulfamoylmethyl)chromen-3-yl]formamide hydrate Formula: C17H16N2O7S MolecularWeight: 392.38314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=C3C(=C2)C(=O)C(=CO3)NC=O)CS(=O)(=O)N.O

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=C3C(=C2)C(=O)C(=CO3)NC=O)CS(=O)(=O)N.O

InChI

InChI=1S/C17H14N2O6S.H2O/c18-26(22,23)9-11-6-16-13(17(21)14(8-24-16)19-10-20)7-15(11)25-12-4-2-1-3-5-12;/h1-8,10H,9H2,(H,19,20)(H2,18,22,23);1H2