1,3-bis[7-[[3,4-bis(oxidanyl)phenyl]methylsulfamoyl]naphthalen-2-yl]urea

Systemtic Name: 1,3-bis[7-[[3,4-bis(oxidanyl)phenyl]methylsulfamoyl]naphthalen-2-yl]urea Openeye Name: 1,3-bis[7-[(3,4-dihydroxyphenyl)methylsulfamoyl]-2-naphthyl]urea CAS Name: 1,3-bis[7-[(3,4-dihydroxyphenyl)methylsulfamoyl]-2-naphthalenyl]urea IUPAC Name: 1,3-bis[7-[(3,4-dihydroxyphenyl)methylsulfamoyl]naphthalen-2-yl]urea Traditional Name: 1,3-bis[7-(protocatechuylsulfamoyl)-2-naphthyl]urea Formula: C35H30N4O9S2 MolecularWeight: 714.7641

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)NCC3=CC(=C(C=C3)O)O)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NCC6=CC(=C(C=C6)O)O

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=C2)S(=O)(=O)NCC3=CC(=C(C=C3)O)O)NC(=O)NC4=CC5=C(C=C4)C=CC(=C5)S(=O)(=O)NCC6=CC(=C(C=C6)O)O

InChI

InChI=1S/C35H30N4O9S2/c40-31-11-1-21(13-33(31)42)19-36-49(45,46)29-9-5-23-3-7-27(15-25(23)17-29)38-35(44)39-28-8-4-24-6-10-30(18-26(24)16-28)50(47,48)37-20-22-2-12-32(41)34(43)14-22/h1-18,36-37,40-43H,19-20H2,(H2,38,39,44)