3-[[6-[5-(3-phosphonopropylcarbamoyl)pyridin-2-yl]pyridin-3-yl]carbonylamino]propylphosphonic acid

Systemtic Name: 3-[[6-[5-(3-phosphonopropylcarbamoyl)pyridin-2-yl]pyridin-3-yl]carbonylamino]propylphosphonic acid Openeye Name: 3-[[6-[5-(3-phosphonopropylcarbamoyl)-2-pyridyl]pyridine-3-carbonyl]amino]propylphosphonic acid CAS Name: 3-[[oxo-[6-[5-[oxo-(3-phosphonopropylamino)methyl]-2-pyridinyl]-3-pyridinyl]methyl]amino]propylphosphonic acid IUPAC Name: 3-[[6-[5-(3-phosphonopropylcarbamoyl)pyridin-2-yl]pyridine-3-carbonyl]amino]propylphosphonic acid Traditional Name: 3-[[6-[5-(3-phosphonopropylcarbamoyl)-2-pyridyl]nicotinoyl]amino]propylphosphonic acid Formula: C18H24N4O8P2 MolecularWeight: 486.352682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1C(=O)NCCCP(=O)(O)O)C2=NC=C(C=C2)C(=O)NCCCP(=O)(O)O

Isomeric SMILES

C1=CC(=NC=C1C(=O)NCCCP(=O)(O)O)C2=NC=C(C=C2)C(=O)NCCCP(=O)(O)O

InChI

InChI=1S/C18H24N4O8P2/c23-17(19-7-1-9-31(25,26)27)13-3-5-15(21-11-13)16-6-4-14(12-22-16)18(24)20-8-2-10-32(28,29)30/h3-6,11-12H,1-2,7-10H2,(H,19,23)(H,20,24)(H2,25,26,27)(H2,28,29,30)