[4-(butoxycarbonylamino)-1-phosphono-butyl]phosphonic acid

Systemtic Name: [4-(butoxycarbonylamino)-1-phosphono-butyl]phosphonic acid Openeye Name: [4-(butoxycarbonylamino)-1-phosphono-butyl]phosphonic acid CAS Name: [4-[[butoxy(oxo)methyl]amino]-1-phosphonobutyl]phosphonic acid IUPAC Name: [4-(butoxycarbonylamino)-1-phosphonobutyl]phosphonic acid Traditional Name: [4-(butoxycarbonylamino)-1-phosphono-butyl]phosphonic acid Formula: C9H21NO8P2 MolecularWeight: 333.212462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NCCCC(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CCCCOC(=O)NCCCC(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C9H21NO8P2/c1-2-3-7-18-9(11)10-6-4-5-8(19(12,13)14)20(15,16)17/h8H,2-7H2,1H3,(H,10,11)(H2,12,13,14)(H2,15,16,17)