[1-oxidanyl-1-phosphono-2-(4-thiophen-3-ylpiperidin-1-yl)propyl]phosphonic acid

Systemtic Name: [1-oxidanyl-1-phosphono-2-(4-thiophen-3-ylpiperidin-1-yl)propyl]phosphonic acid Openeye Name: [1-hydroxy-1-phosphono-2-[4-(3-thienyl)-1-piperidyl]propyl]phosphonic acid CAS Name: [1-hydroxy-1-phosphono-2-[4-(3-thiophenyl)-1-piperidinyl]propyl]phosphonic acid IUPAC Name: [1-hydroxy-1-phosphono-2-(4-thiophen-3-ylpiperidin-1-yl)propyl]phosphonic acid Traditional Name: [1-hydroxy-1-phosphono-2-[4-(3-thienyl)piperidino]propyl]phosphonic acid Formula: C12H21NO7P2S MolecularWeight: 385.310162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(O)(P(=O)(O)O)P(=O)(O)O)N1CCC(CC1)C2=CSC=C2

Isomeric SMILES

CC(C(O)(P(=O)(O)O)P(=O)(O)O)N1CCC(CC1)C2=CSC=C2

InChI

InChI=1S/C12H21NO7P2S/c1-9(12(14,21(15,16)17)22(18,19)20)13-5-2-10(3-6-13)11-4-7-23-8-11/h4,7-10,14H,2-3,5-6H2,1H3,(H2,15,16,17)(H2,18,19,20)