[4-[(2,4-dichlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxy-phenyl]methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [4-[(2,4-dichlorophenyl)methoxy]-3-ethoxyphenyl]methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: [4-(2,4-dichlorobenzyl)oxy-3-ethoxy-benzyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C22H26Cl2N3O2+ MolecularWeight: 435.36674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCCN2C=CN=C2)OCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCCN2C=CN=C2)OCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O2/c1-2-28-22-12-17(14-25-8-3-10-27-11-9-26-16-27)4-7-21(22)29-15-18-5-6-19(23)13-20(18)24/h4-7,9,11-13,16,25H,2-3,8,10,14-15H2,1H3/p+1