[4-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [4-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [4-[(2-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [4-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [4-(2-chlorobenzyl)oxy-3-methoxy-benzyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C22H31ClN2O3+2 MolecularWeight: 406.94614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CCC[NH+]2CCOCC2)OCC3=CC=CC=C3Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CCC[NH+]2CCOCC2)OCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H29ClN2O3/c1-26-22-15-18(16-24-9-4-10-25-11-13-27-14-12-25)7-8-21(22)28-17-19-5-2-3-6-20(19)23/h2-3,5-8,15,24H,4,9-14,16-17H2,1H3/p+2