N-methyl-5-phenyl-pentan-1-amine; (1-oxidanyl-1-phosphono-propyl)phosphonic acid

Systemtic Name: N-methyl-5-phenyl-pentan-1-amine; (1-oxidanyl-1-phosphono-propyl)phosphonic acid Openeye Name: (1-hydroxy-1-phosphono-propyl)phosphonic acid; N-methyl-5-phenyl-pentan-1-amine CAS Name: (1-hydroxy-1-phosphonopropyl)phosphonic acid; N-methyl-5-phenyl-1-pentanamine IUPAC Name: (1-hydroxy-1-phosphonopropyl)phosphonic acid; N-methyl-5-phenylpentan-1-amine Traditional Name: (1-hydroxy-1-phosphono-propyl)phosphonic acid; methyl(5-phenylpentyl)amine Formula: C15H29NO7P2 MolecularWeight: 397.340782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(O)(P(=O)(O)O)P(=O)(O)O.CNCCCCCC1=CC=CC=C1

Isomeric SMILES

CCC(O)(P(=O)(O)O)P(=O)(O)O.CNCCCCCC1=CC=CC=C1

InChI

InChI=1S/C12H19N.C3H10O7P2/c1-13-11-7-3-6-10-12-8-4-2-5-9-12;1-2-3(4,11(5,6)7)12(8,9)10/h2,4-5,8-9,13H,3,6-7,10-11H2,1H3;4H,2H2,1H3,(H2,5,6,7)(H2,8,9,10)