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

Systemtic Name: (3-methoxy-4-phenylmethoxy-phenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: (4-benzyloxy-3-methoxy-phenyl)methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: (3-methoxy-4-phenylmethoxyphenyl)methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: (3-methoxy-4-phenylmethoxyphenyl)methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: (4-benzoxy-3-methoxy-benzyl)-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C21H30N2O3+2 MolecularWeight: 358.4745

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CC[NH+]2CCOCC2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CC[NH+]2CCOCC2)OCC3=CC=CC=C3

InChI

InChI=1S/C21H28N2O3/c1-24-21-15-19(16-22-9-10-23-11-13-25-14-12-23)7-8-20(21)26-17-18-5-3-2-4-6-18/h2-8,15,22H,9-14,16-17H2,1H3/p+2