[[(2-azanyl-4-nitro-5-sulfamoyl-naphthalen-1-yl)amino]-phenyl-methyl]phosphonic acid

Systemtic Name: [[(2-azanyl-4-nitro-5-sulfamoyl-naphthalen-1-yl)amino]-phenyl-methyl]phosphonic acid Openeye Name: [[(2-amino-4-nitro-5-sulfamoyl-1-naphthyl)amino]-phenyl-methyl]phosphonic acid CAS Name: [[(2-amino-4-nitro-5-sulfamoyl-1-naphthalenyl)amino]-phenylmethyl]phosphonic acid IUPAC Name: [[(2-amino-4-nitro-5-sulfamoylnaphthalen-1-yl)amino]-phenylmethyl]phosphonic acid Traditional Name: [[(2-amino-4-nitro-5-sulfamoyl-1-naphthyl)amino]-phenyl-methyl]phosphonic acid Formula: C17H17N4O7PS MolecularWeight: 452.378241

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NC2=C3C=CC=C(C3=C(C=C2N)[N+](=O)[O-])S(=O)(=O)N)P(=O)(O)O

Isomeric SMILES

C1=CC=C(C=C1)C(NC2=C3C=CC=C(C3=C(C=C2N)[N+](=O)[O-])S(=O)(=O)N)P(=O)(O)O

InChI

InChI=1S/C17H17N4O7PS/c18-12-9-13(21(22)23)15-11(7-4-8-14(15)30(19,27)28)16(12)20-17(29(24,25)26)10-5-2-1-3-6-10/h1-9,17,20H,18H2,(H2,19,27,28)(H2,24,25,26)