2-(3,4-dimethoxyphenyl)ethyl-[(3-methoxy-2-phenylmethoxy-phenyl)methyl]azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methoxy-2-phenylmethoxy-phenyl)methyl]azanium Openeye Name: (2-benzyloxy-3-methoxy-phenyl)methyl-[2-(3,4-dimethoxyphenyl)ethyl]ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methoxy-2-phenylmethoxyphenyl)methyl]ammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[(3-methoxy-2-phenylmethoxyphenyl)methyl]azanium Traditional Name: (2-benzoxy-3-methoxy-benzyl)-homoveratryl-ammonium Formula: C25H30NO4+ MolecularWeight: 408.51

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC2=C(C(=CC=C2)OC)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC2=C(C(=CC=C2)OC)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C25H29NO4/c1-27-22-13-12-19(16-24(22)29-3)14-15-26-17-21-10-7-11-23(28-2)25(21)30-18-20-8-5-4-6-9-20/h4-13,16,26H,14-15,17-18H2,1-3H3/p+1