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

Systemtic Name: [(2S)-butan-2-yl]-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]azanium Openeye Name: 2-(2-allyl-4-chloro-phenoxy)ethyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]azanium Traditional Name: 2-(2-allyl-4-chloro-phenoxy)ethyl-[(1S)-1-methylpropyl]ammonium Formula: C15H23ClNO+ MolecularWeight: 268.80222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCOC1=C(C=C(C=C1)Cl)CC=C

Isomeric SMILES

CC[C@H](C)[NH2+]CCOC1=C(C=C(C=C1)Cl)CC=C

InChI

InChI=1S/C15H22ClNO/c1-4-6-13-11-14(16)7-8-15(13)18-10-9-17-12(3)5-2/h4,7-8,11-12,17H,1,5-6,9-10H2,2-3H3/p+1/t12-/m0/s1