(1-phosphonocycloheptyl)phosphonic acid; (1-phosphonocyclohex-3-en-1-yl)phosphonic acid

Systemtic Name: (1-phosphonocycloheptyl)phosphonic acid; (1-phosphonocyclohex-3-en-1-yl)phosphonic acid Openeye Name: (1-phosphonocycloheptyl)phosphonic acid; (1-phosphonocyclohex-3-en-1-yl)phosphonic acid CAS Name: (1-phosphonocycloheptyl)phosphonic acid; (1-phosphono-1-cyclohex-3-enyl)phosphonic acid IUPAC Name: (1-phosphonocycloheptyl)phosphonic acid; (1-phosphonocyclohex-3-en-1-yl)phosphonic acid Traditional Name: (1-phosphonocycloheptyl)phosphonic acid; (1-phosphonocyclohex-3-en-1-yl)phosphonic acid Formula: C13H28O12P4 MolecularWeight: 500.249264

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(P(=O)(O)O)P(=O)(O)O.C1CC(CC=C1)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C1CCCC(CC1)(P(=O)(O)O)P(=O)(O)O.C1CC(CC=C1)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C7H16O6P2.C6H12O6P2/c8-14(9,10)7(15(11,12)13)5-3-1-2-4-6-7;7-13(8,9)6(14(10,11)12)4-2-1-3-5-6/h1-6H2,(H2,8,9,10)(H2,11,12,13);1-2H,3-5H2,(H2,7,8,9)(H2,10,11,12)