(azanyl-phosphono-quinolin-8-ylsulfonyl-methyl)phosphonic acid

Systemtic Name: (azanyl-phosphono-quinolin-8-ylsulfonyl-methyl)phosphonic acid Openeye Name: [amino-phosphono-(8-quinolylsulfonyl)methyl]phosphonic acid CAS Name: [amino-phosphono-(8-quinolinylsulfonyl)methyl]phosphonic acid IUPAC Name: (amino-phosphono-quinolin-8-ylsulfonylmethyl)phosphonic acid Traditional Name: [amino-phosphono-(8-quinolylsulfonyl)methyl]phosphonic acid Formula: C10H12N2O8P2S MolecularWeight: 382.223402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)C(N)(P(=O)(O)O)P(=O)(O)O)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)C(N)(P(=O)(O)O)P(=O)(O)O)N=CC=C2

InChI

InChI=1S/C10H12N2O8P2S/c11-10(21(13,14)15,22(16,17)18)23(19,20)8-5-1-3-7-4-2-6-12-9(7)8/h1-6H,11H2,(H2,13,14,15)(H2,16,17,18)