sodium [(4-nitrophenyl)carbamoylamino]methanesulfonic acid

Systemtic Name: sodium [(4-nitrophenyl)carbamoylamino]methanesulfonic acid Openeye Name: sodium [(4-nitrophenyl)carbamoylamino]methanesulfonic acid CAS Name: sodium [[(4-nitroanilino)-oxomethyl]amino]methanesulfonic acid IUPAC Name: sodium [(4-nitrophenyl)carbamoylamino]methanesulfonic acid Traditional Name: sodium [(4-nitrophenyl)carbamoylamino]methanesulfonic acid Formula: C8H8N3NaO6S MolecularWeight: 297.22039

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)N[CH-]S(=O)(=O)O)[N+](=O)[O-].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)N[CH-]S(=O)(=O)O)[N+](=O)[O-].[Na+]

InChI

InChI=1S/C8H8N3O6S.Na/c12-8(9-5-18(15,16)17)10-6-1-3-7(4-2-6)11(13)14;/h1-5H,(H2,9,10,12)(H,15,16,17);/q-1;+1