[(2S)-5-methylhexan-2-yl]-[(4-piperidin-1-ylphenyl)methyl]azanium

Systemtic Name: [(2S)-5-methylhexan-2-yl]-[(4-piperidin-1-ylphenyl)methyl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[[4-(1-piperidyl)phenyl]methyl]ammonium CAS Name: [(2S)-5-methylhexan-2-yl]-[[4-(1-piperidinyl)phenyl]methyl]ammonium IUPAC Name: [(2S)-5-methylhexan-2-yl]-[(4-piperidin-1-ylphenyl)methyl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-(4-piperidinobenzyl)ammonium Formula: C19H33N2+ MolecularWeight: 289.47872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)[NH2+]CC1=CC=C(C=C1)N2CCCCC2

Isomeric SMILES

C[C@@H](CCC(C)C)[NH2+]CC1=CC=C(C=C1)N2CCCCC2

InChI

InChI=1S/C19H32N2/c1-16(2)7-8-17(3)20-15-18-9-11-19(12-10-18)21-13-5-4-6-14-21/h9-12,16-17,20H,4-8,13-15H2,1-3H3/p+1/t17-/m0/s1