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[(1S,3S)-3-[(4-nonylphenyl)methylamino]cyclohexyl]phosphonic acid

[(1S,3S)-3-[(4-nonylphenyl)methylamino]cyclohexyl]phosphonic acid

Systemtic Name:[(1S,3S)-3-[(4-nonylphenyl)methylamino]cyclohexyl]phosphonic acid
Openeye Name:[(1S,3S)-3-[(4-nonylphenyl)methylamino]cyclohexyl]phosphonic acid
CAS Name:[(1S,3S)-3-[(4-nonylphenyl)methylamino]cyclohexyl]phosphonic acid
IUPAC Name:[(1S,3S)-3-[(4-nonylphenyl)methylamino]cyclohexyl]phosphonic acid
Traditional Name:[(1S,3S)-3-[(4-nonylbenzyl)amino]cyclohexyl]phosphonic acid
Formula: C22H38NO3P
MolecularWeight: 395.515781
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)CNC2CCCC(C2)P(=O)(O)O


Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)CN[C@H]2CCC[C@@H](C2)P(=O)(O)O


InChI

InChI=1S/C22H38NO3P/c1-2-3-4-5-6-7-8-10-19-13-15-20(16-14-19)18-23-21-11-9-12-22(17-21)27(24,25)26/h13-16,21-23H,2-12,17-18H2,1H3,(H2,24,25,26)/t21-,22-/m0/s1


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