(2-chloranyl-4,5-dimethoxy-phenyl)methyl-prop-2-enyl-azanium

Systemtic Name: (2-chloranyl-4,5-dimethoxy-phenyl)methyl-prop-2-enyl-azanium Openeye Name: allyl-[(2-chloro-4,5-dimethoxy-phenyl)methyl]ammonium CAS Name: (2-chloro-4,5-dimethoxyphenyl)methyl-prop-2-enylammonium IUPAC Name: (2-chloro-4,5-dimethoxyphenyl)methyl-prop-2-enylazanium Traditional Name: allyl-(2-chloro-4,5-dimethoxy-benzyl)ammonium Formula: C12H17ClNO2+ MolecularWeight: 242.72188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C[NH2+]CC=C)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C[NH2+]CC=C)Cl)OC

InChI

InChI=1S/C12H16ClNO2/c1-4-5-14-8-9-6-11(15-2)12(16-3)7-10(9)13/h4,6-7,14H,1,5,8H2,2-3H3/p+1