[(2R)-3-(2-chloranyl-5-methyl-phenoxy)-2-oxidanyl-propyl]-prop-2-enyl-azanium

Systemtic Name: [(2R)-3-(2-chloranyl-5-methyl-phenoxy)-2-oxidanyl-propyl]-prop-2-enyl-azanium Openeye Name: allyl-[(2R)-3-(2-chloro-5-methyl-phenoxy)-2-hydroxy-propyl]ammonium CAS Name: [(2R)-3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]-prop-2-enylammonium IUPAC Name: [(2R)-3-(2-chloro-5-methylphenoxy)-2-hydroxypropyl]-prop-2-enylazanium Traditional Name: allyl-[(2R)-3-(2-chloro-5-methyl-phenoxy)-2-hydroxy-propyl]ammonium Formula: C13H19ClNO2+ MolecularWeight: 256.74846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCC(C[NH2+]CC=C)O

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OC[C@@H](C[NH2+]CC=C)O

InChI

InChI=1S/C13H18ClNO2/c1-3-6-15-8-11(16)9-17-13-7-10(2)4-5-12(13)14/h3-5,7,11,15-16H,1,6,8-9H2,2H3/p+1/t11-/m1/s1