(3-ethoxy-4-phenylmethoxy-phenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium

Systemtic Name: (3-ethoxy-4-phenylmethoxy-phenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: (4-benzyloxy-3-ethoxy-phenyl)methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: (3-ethoxy-4-phenylmethoxyphenyl)methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: (3-ethoxy-4-phenylmethoxyphenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: (4-benzoxy-3-ethoxy-benzyl)-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C22H32N2O3+2 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CC[NH+]2CCOCC2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CC[NH+]2CCOCC2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O3/c1-2-26-22-16-20(17-23-10-11-24-12-14-25-15-13-24)8-9-21(22)27-18-19-6-4-3-5-7-19/h3-9,16,23H,2,10-15,17-18H2,1H3/p+2