2-(4-chlorophenyl)ethyl-[(2S)-heptan-2-yl]azanium

Systemtic Name: 2-(4-chlorophenyl)ethyl-[(2S)-heptan-2-yl]azanium Openeye Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-methylhexyl]ammonium CAS Name: 2-(4-chlorophenyl)ethyl-[(2S)-heptan-2-yl]ammonium IUPAC Name: 2-(4-chlorophenyl)ethyl-[(2S)-heptan-2-yl]azanium Traditional Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-methylhexyl]ammonium Formula: C15H25ClN+ MolecularWeight: 254.8187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CCC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H24ClN/c1-3-4-5-6-13(2)17-12-11-14-7-9-15(16)10-8-14/h7-10,13,17H,3-6,11-12H2,1-2H3/p+1/t13-/m0/s1