[5-azanyl-3-(1-oxidanylhexyl)-2-phosphono-3H-inden-1-yl]phosphonic acid

Systemtic Name: [5-azanyl-3-(1-oxidanylhexyl)-2-phosphono-3H-inden-1-yl]phosphonic acid Openeye Name: [5-amino-3-(1-hydroxyhexyl)-2-phosphono-3H-inden-1-yl]phosphonic acid CAS Name: [5-amino-3-(1-hydroxyhexyl)-2-phosphono-3H-inden-1-yl]phosphonic acid IUPAC Name: [5-amino-3-(1-hydroxyhexyl)-2-phosphono-3H-inden-1-yl]phosphonic acid Traditional Name: [5-amino-3-(1-hydroxyhexyl)-2-phosphono-3H-inden-1-yl]phosphonic acid Formula: C15H23NO7P2 MolecularWeight: 391.293142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1C2=C(C=CC(=C2)N)C(=C1P(=O)(O)O)P(=O)(O)O)O

Isomeric SMILES

CCCCCC(C1C2=C(C=CC(=C2)N)C(=C1P(=O)(O)O)P(=O)(O)O)O

InChI

InChI=1S/C15H23NO7P2/c1-2-3-4-5-12(17)13-11-8-9(16)6-7-10(11)14(24(18,19)20)15(13)25(21,22)23/h6-8,12-13,17H,2-5,16H2,1H3,(H2,18,19,20)(H2,21,22,23)