4-(naphthalen-2-ylamino)-3-nitro-5-sulfamoyl-benzoic acid

Systemtic Name: 4-(naphthalen-2-ylamino)-3-nitro-5-sulfamoyl-benzoic acid Openeye Name: 4-(2-naphthylamino)-3-nitro-5-sulfamoyl-benzoic acid CAS Name: 4-(2-naphthalenylamino)-3-nitro-5-sulfamoylbenzoic acid IUPAC Name: 4-(naphthalen-2-ylamino)-3-nitro-5-sulfamoylbenzoic acid Traditional Name: 4-(2-naphthylamino)-3-nitro-5-sulfamoyl-benzoic acid Formula: C17H13N3O6S MolecularWeight: 387.36662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)NC3=C(C=C(C=C3S(=O)(=O)N)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)NC3=C(C=C(C=C3S(=O)(=O)N)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O6S/c18-27(25,26)15-9-12(17(21)22)8-14(20(23)24)16(15)19-13-6-5-10-3-1-2-4-11(10)7-13/h1-9,19H,(H,21,22)(H2,18,25,26)