[3-[2-(3,4-dihydro-2H-chromen-3-yl)ethyl-methyl-amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-[2-(3,4-dihydro-2H-chromen-3-yl)ethyl-methyl-amino]-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [3-[2-chroman-3-ylethyl(methyl)amino]-1-hydroxy-1-phosphono-propyl]phosphonic acid CAS Name: [3-[2-(3,4-dihydro-2H-1-benzopyran-3-yl)ethyl-methylamino]-1-hydroxy-1-phosphonopropyl]phosphonic acid IUPAC Name: [3-[2-(3,4-dihydro-2H-chromen-3-yl)ethyl-methylamino]-1-hydroxy-1-phosphonopropyl]phosphonic acid Traditional Name: [3-[2-chroman-3-ylethyl(methyl)amino]-1-hydroxy-1-phosphono-propyl]phosphonic acid Formula: C15H25NO8P2 MolecularWeight: 409.308422

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1CC2=CC=CC=C2OC1)CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CN(CCC1CC2=CC=CC=C2OC1)CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C15H25NO8P2/c1-16(9-7-15(17,25(18,19)20)26(21,22)23)8-6-12-10-13-4-2-3-5-14(13)24-11-12/h2-5,12,17H,6-11H2,1H3,(H2,18,19,20)(H2,21,22,23)