N1-methoxy-8-oxidanyl-pyrene-1,3,6-trisulfonamide

Systemtic Name: N1-methoxy-8-oxidanyl-pyrene-1,3,6-trisulfonamide Openeye Name: 8-hydroxy-N1-methoxy-pyrene-1,3,6-trisulfonamide CAS Name: 8-hydroxy-N1-methoxypyrene-1,3,6-trisulfonamide IUPAC Name: 8-hydroxy-1-N-methoxypyrene-1,3,6-trisulfonamide Traditional Name: 8-hydroxy-N1-methoxy-pyrene-1,3,6-trisulfonamide Formula: C17H15N3O8S3 MolecularWeight: 485.5113

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Descriptors Computed from Structure

Canonical SMILES:

CONS(=O)(=O)C1=C2C=CC3=C4C2=C(C=CC4=C(C=C3O)S(=O)(=O)N)C(=C1)S(=O)(=O)N

Isomeric SMILES

CONS(=O)(=O)C1=C2C=CC3=C4C2=C(C=CC4=C(C=C3O)S(=O)(=O)N)C(=C1)S(=O)(=O)N

InChI

InChI=1S/C17H15N3O8S3/c1-28-20-31(26,27)15-7-14(30(19,24)25)10-5-4-9-13(29(18,22)23)6-12(21)8-2-3-11(15)17(10)16(8)9/h2-7,20-21H,1H3,(H2,18,22,23)(H2,19,24,25)