[(2S)-butan-2-yl]-[(3-phenoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(3-phenoxyphenyl)methyl]azanium Openeye Name: [(1S)-1-methylpropyl]-[(3-phenoxyphenyl)methyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(3-phenoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(3-phenoxyphenyl)methyl]azanium Traditional Name: [(1S)-1-methylpropyl]-(3-phenoxybenzyl)ammonium Formula: C17H22NO+ MolecularWeight: 256.36268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C17H21NO/c1-3-14(2)18-13-15-8-7-11-17(12-15)19-16-9-5-4-6-10-16/h4-12,14,18H,3,13H2,1-2H3/p+1/t14-/m0/s1