[3-[4-(3-carboxyoxy-1-cyclopropyl-4-oxidanylidene-1,6-naphthyridin-7-yl)piperazin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-4-oxidanylidene-1,6-naphthyridin-7-yl)piperazin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-4-oxo-1,6-naphthyridin-7-yl)piperazin-1-yl]-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-4-oxo-1,6-naphthyridin-7-yl)-1-piperazinyl]-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-4-oxo-1,6-naphthyridin-7-yl)piperazin-1-yl]-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [3-[4-(3-carboxyoxy-1-cyclopropyl-4-keto-1,6-naphthyridin-7-yl)piperazino]-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C19H26N4O11P2 MolecularWeight: 548.377462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CN=C(C=C32)N4CCN(CC4)CCC(O)(P(=O)(O)O)P(=O)(O)O)OC(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CN=C(C=C32)N4CCN(CC4)CCC(O)(P(=O)(O)O)P(=O)(O)O)OC(=O)O

InChI

InChI=1S/C19H26N4O11P2/c24-17-13-10-20-16(9-14(13)23(12-1-2-12)11-15(17)34-18(25)26)22-7-5-21(6-8-22)4-3-19(27,35(28,29)30)36(31,32)33/h9-12,27H,1-8H2,(H,25,26)(H2,28,29,30)(H2,31,32,33)