2-(4-chlorophenyl)ethyl-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name: 2-(4-chlorophenyl)ethyl-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]azanium Openeye Name: 2-(4-chlorophenyl)ethyl-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]ammonium CAS Name: 2-(4-chlorophenyl)ethyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]ammonium IUPAC Name: 2-(4-chlorophenyl)ethyl-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]azanium Traditional Name: 2-(4-chlorophenyl)ethyl-(4-hydroxy-3,5-dimethoxy-benzyl)ammonium Formula: C17H21ClNO3+ MolecularWeight: 322.80654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C[NH2+]CCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C[NH2+]CCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClNO3/c1-21-15-9-13(10-16(22-2)17(15)20)11-19-8-7-12-3-5-14(18)6-4-12/h3-6,9-10,19-20H,7-8,11H2,1-2H3/p+1