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2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-nitrophenyl)methyl]azanium

2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-nitrophenyl)methyl]azanium

Systemtic Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-nitrophenyl)methyl]azanium
Openeye Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-nitrophenyl)methyl]ammonium
CAS Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-nitrophenyl)methyl]ammonium
IUPAC Name:2-(3,4-dimethoxyphenyl)ethyl-methyl-[(3-nitrophenyl)methyl]azanium
Traditional Name:homoveratryl-methyl-(3-nitrobenzyl)ammonium
Formula: C18H23N2O4+
MolecularWeight: 331.38622
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=CC(=CC=C2)[N+](=O)[O-]


Isomeric SMILES

C[NH+](CCC1=CC(=C(C=C1)OC)OC)CC2=CC(=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C18H22N2O4/c1-19(13-15-5-4-6-16(11-15)20(21)22)10-9-14-7-8-17(23-2)18(12-14)24-3/h4-8,11-12H,9-10,13H2,1-3H3/p+1


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