[3,5-bis(chloranyl)-4-prop-2-enoxy-phenyl]methyl-(3-oxidanylpropyl)azanium

Systemtic Name: [3,5-bis(chloranyl)-4-prop-2-enoxy-phenyl]methyl-(3-oxidanylpropyl)azanium Openeye Name: (4-allyloxy-3,5-dichloro-phenyl)methyl-(3-hydroxypropyl)ammonium CAS Name: (3,5-dichloro-4-prop-2-enoxyphenyl)methyl-(3-hydroxypropyl)ammonium IUPAC Name: (3,5-dichloro-4-prop-2-enoxyphenyl)methyl-(3-hydroxypropyl)azanium Traditional Name: (4-allyloxy-3,5-dichloro-benzyl)-(3-hydroxypropyl)ammonium Formula: C13H18Cl2NO2+ MolecularWeight: 291.19352

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1Cl)C[NH2+]CCCO)Cl

Isomeric SMILES

C=CCOC1=C(C=C(C=C1Cl)C[NH2+]CCCO)Cl

InChI

InChI=1S/C13H17Cl2NO2/c1-2-6-18-13-11(14)7-10(8-12(13)15)9-16-4-3-5-17/h2,7-8,16-17H,1,3-6,9H2/p+1