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

Systemtic Name: [4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Openeye Name: [4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyl-(2-morpholin-4-ium-4-ylethyl)ammonium CAS Name: [4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-[2-(4-morpholin-4-iumyl)ethyl]ammonium IUPAC Name: [4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methyl-(2-morpholin-4-ium-4-ylethyl)azanium Traditional Name: [4-(4-chlorobenzyl)oxy-3-methoxy-benzyl]-(2-morpholin-4-ium-4-ylethyl)ammonium Formula: C21H29ClN2O3+2 MolecularWeight: 392.91956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O3/c1-25-21-14-18(15-23-8-9-24-10-12-26-13-11-24)4-7-20(21)27-16-17-2-5-19(22)6-3-17/h2-7,14,23H,8-13,15-16H2,1H3/p+2