8-[(4-fluorosulfonylphenyl)carbamoylamino]-7-oxidanyl-naphthalene-1-sulfonic acid

Systemtic Name: 8-[(4-fluorosulfonylphenyl)carbamoylamino]-7-oxidanyl-naphthalene-1-sulfonic acid Openeye Name: 8-[(4-fluorosulfonylphenyl)carbamoylamino]-7-hydroxy-naphthalene-1-sulfonic acid CAS Name: 8-[[(4-fluorosulfonylanilino)-oxomethyl]amino]-7-hydroxy-1-naphthalenesulfonic acid IUPAC Name: 8-[(4-fluorosulfonylphenyl)carbamoylamino]-7-hydroxynaphthalene-1-sulfonic acid Traditional Name: 8-[(4-fluorosulfonylphenyl)carbamoylamino]-7-hydroxy-naphthalene-1-sulfonic acid Formula: C17H13FN2O7S2 MolecularWeight: 440.422723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)O)C(=C(C=C2)O)NC(=O)NC3=CC=C(C=C3)S(=O)(=O)F

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)O)C(=C(C=C2)O)NC(=O)NC3=CC=C(C=C3)S(=O)(=O)F

InChI

InChI=1S/C17H13FN2O7S2/c18-28(23,24)12-7-5-11(6-8-12)19-17(22)20-16-13(21)9-4-10-2-1-3-14(15(10)16)29(25,26)27/h1-9,21H,(H2,19,20,22)(H,25,26,27)