[4-(diethylamino)phenyl]methyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: [4-(diethylamino)phenyl]methyl-[(2S)-pentan-2-yl]azanium Openeye Name: [4-(diethylamino)phenyl]methyl-[(1S)-1-methylbutyl]ammonium CAS Name: [4-(diethylamino)phenyl]methyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: [4-(diethylamino)phenyl]methyl-[(2S)-pentan-2-yl]azanium Traditional Name: [4-(diethylamino)benzyl]-[(1S)-1-methylbutyl]ammonium Formula: C16H29N2+ MolecularWeight: 249.41486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]CC1=CC=C(C=C1)N(CC)CC

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-5-8-14(4)17-13-15-9-11-16(12-10-15)18(6-2)7-3/h9-12,14,17H,5-8,13H2,1-4H3/p+1/t14-/m0/s1