4-[2-[(2S)-butan-2-yl]phenoxy]butyl-prop-2-enyl-azanium

Systemtic Name: 4-[2-[(2S)-butan-2-yl]phenoxy]butyl-prop-2-enyl-azanium Openeye Name: allyl-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]ammonium CAS Name: 4-[2-[(2S)-butan-2-yl]phenoxy]butyl-prop-2-enylammonium IUPAC Name: 4-[2-[(2S)-butan-2-yl]phenoxy]butyl-prop-2-enylazanium Traditional Name: allyl-[4-[2-[(1S)-1-methylpropyl]phenoxy]butyl]ammonium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCCCC[NH2+]CC=C

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCCCC[NH2+]CC=C

InChI

InChI=1S/C17H27NO/c1-4-12-18-13-8-9-14-19-17-11-7-6-10-16(17)15(3)5-2/h4,6-7,10-11,15,18H,1,5,8-9,12-14H2,2-3H3/p+1/t15-/m0/s1