[3-[4-(4-chlorophenyl)-3-methylidene-piperidin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[4-(4-chlorophenyl)-3-methylidene-piperidin-1-yl]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [3-[4-(4-chlorophenyl)-3-methylene-1-piperidyl]-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [3-[4-(4-chlorophenyl)-3-methylene-1-piperidinyl]-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-[4-(4-chlorophenyl)-3-methylidenepiperidin-1-yl]-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [3-[4-(4-chlorophenyl)-3-methylene-piperidino]-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C15H22ClNO7P2 MolecularWeight: 425.738202

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CN(CCC1C2=CC=C(C=C2)Cl)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

C=C1CN(CCC1C2=CC=C(C=C2)Cl)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C15H22ClNO7P2/c1-11-10-17(8-6-14(11)12-2-4-13(16)5-3-12)9-7-15(18,25(19,20)21)26(22,23)24/h2-5,14,18H,1,6-10H2,(H2,19,20,21)(H2,22,23,24)