2-(4-chlorophenyl)ethyl-[(1S,3S)-3-methyl-1-phosphonato-cyclohexyl]azanium

Systemtic Name: 2-(4-chlorophenyl)ethyl-[(1S,3S)-3-methyl-1-phosphonato-cyclohexyl]azanium Openeye Name: 2-(4-chlorophenyl)ethyl-[(1S,3S)-3-methyl-1-phosphonato-cyclohexyl]ammonium CAS Name: 2-(4-chlorophenyl)ethyl-[(1S,3S)-3-methyl-1-phosphonatocyclohexyl]ammonium IUPAC Name: 2-(4-chlorophenyl)ethyl-[(1S,3S)-3-methyl-1-phosphonatocyclohexyl]azanium Traditional Name: 2-(4-chlorophenyl)ethyl-[(1S,3S)-3-methyl-1-phosphonato-cyclohexyl]ammonium Formula: C15H22ClNO3P- MolecularWeight: 330.766841

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)([NH2+]CCC2=CC=C(C=C2)Cl)P(=O)([O-])[O-]

Isomeric SMILES

C[C@H]1CCC[C@](C1)([NH2+]CCC2=CC=C(C=C2)Cl)P(=O)([O-])[O-]

InChI

InChI=1S/C15H23ClNO3P/c1-12-3-2-9-15(11-12,21(18,19)20)17-10-8-13-4-6-14(16)7-5-13/h4-7,12,17H,2-3,8-11H2,1H3,(H2,18,19,20)/p-1/t12-,15-/m0/s1