(4-chlorophenyl)methyl-[(2S)-octan-2-yl]azanium

Systemtic Name: (4-chlorophenyl)methyl-[(2S)-octan-2-yl]azanium Openeye Name: (4-chlorophenyl)methyl-[(1S)-1-methylheptyl]ammonium CAS Name: (4-chlorophenyl)methyl-[(2S)-octan-2-yl]ammonium IUPAC Name: (4-chlorophenyl)methyl-[(2S)-octan-2-yl]azanium Traditional Name: (4-chlorobenzyl)-[(1S)-1-methylheptyl]ammonium Formula: C15H25ClN+ MolecularWeight: 254.8187

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]CC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]CC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H24ClN/c1-3-4-5-6-7-13(2)17-12-14-8-10-15(16)11-9-14/h8-11,13,17H,3-7,12H2,1-2H3/p+1/t13-/m0/s1