3-[(2,4-dimethoxyphenyl)methyl-phenyl-amino]propylazanium

Systemtic Name: 3-[(2,4-dimethoxyphenyl)methyl-phenyl-amino]propylazanium Openeye Name: 3-[N-[(2,4-dimethoxyphenyl)methyl]anilino]propylammonium CAS Name: 3-[N-[(2,4-dimethoxyphenyl)methyl]anilino]propylammonium IUPAC Name: 3-[N-[(2,4-dimethoxyphenyl)methyl]anilino]propylazanium Traditional Name: 3-(N-(2,4-dimethoxybenzyl)anilino)propylammonium Formula: C18H25N2O2+ MolecularWeight: 301.4033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CN(CCC[NH3+])C2=CC=CC=C2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CN(CCC[NH3+])C2=CC=CC=C2)OC

InChI

InChI=1S/C18H24N2O2/c1-21-17-10-9-15(18(13-17)22-2)14-20(12-6-11-19)16-7-4-3-5-8-16/h3-5,7-10,13H,6,11-12,14,19H2,1-2H3/p+1