(4-butoxy-3-chloranyl-5-ethoxy-phenyl)methyl-methyl-azanium

Systemtic Name: (4-butoxy-3-chloranyl-5-ethoxy-phenyl)methyl-methyl-azanium Openeye Name: (4-butoxy-3-chloro-5-ethoxy-phenyl)methyl-methyl-ammonium CAS Name: (4-butoxy-3-chloro-5-ethoxyphenyl)methyl-methylammonium IUPAC Name: (4-butoxy-3-chloro-5-ethoxyphenyl)methyl-methylazanium Traditional Name: (4-butoxy-3-chloro-5-ethoxy-benzyl)-methyl-ammonium Formula: C14H23ClNO2+ MolecularWeight: 272.79092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C[NH2+]C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C[NH2+]C)OCC

InChI

InChI=1S/C14H22ClNO2/c1-4-6-7-18-14-12(15)8-11(10-16-3)9-13(14)17-5-2/h8-9,16H,4-7,10H2,1-3H3/p+1