(3,4-dimethoxyphenyl)methyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium

Systemtic Name: (3,4-dimethoxyphenyl)methyl-[(3-methoxy-4-oxidanyl-phenyl)methyl]azanium Openeye Name: (3,4-dimethoxyphenyl)methyl-[(4-hydroxy-3-methoxy-phenyl)methyl]ammonium CAS Name: (3,4-dimethoxyphenyl)methyl-[(4-hydroxy-3-methoxyphenyl)methyl]ammonium IUPAC Name: (3,4-dimethoxyphenyl)methyl-[(4-hydroxy-3-methoxyphenyl)methyl]azanium Traditional Name: vanillyl(veratryl)ammonium Formula: C17H22NO4+ MolecularWeight: 304.36088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CC2=CC(=C(C=C2)O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CC2=CC(=C(C=C2)O)OC)OC

InChI

InChI=1S/C17H21NO4/c1-20-15-7-5-13(9-17(15)22-3)11-18-10-12-4-6-14(19)16(8-12)21-2/h4-9,18-19H,10-11H2,1-3H3/p+1