[(2S)-butan-2-yl]-[(E)-3-(2-methoxyphenyl)prop-2-enyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(E)-3-(2-methoxyphenyl)prop-2-enyl]azanium Openeye Name: [(E)-3-(2-methoxyphenyl)allyl]-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(E)-3-(2-methoxyphenyl)prop-2-enyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(E)-3-(2-methoxyphenyl)prop-2-enyl]azanium Traditional Name: [(E)-3-(2-methoxyphenyl)allyl]-[(1S)-1-methylpropyl]ammonium Formula: C14H22NO+ MolecularWeight: 220.33058

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC=CC1=CC=CC=C1OC

Isomeric SMILES

CC[C@H](C)[NH2+]C/C=C/C1=CC=CC=C1OC

InChI

InChI=1S/C14H21NO/c1-4-12(2)15-11-7-9-13-8-5-6-10-14(13)16-3/h5-10,12,15H,4,11H2,1-3H3/p+1/b9-7+/t12-/m0/s1