[4-[(2,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [4-[(2,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [4-[(2,4-dichlorophenyl)methoxy]-3-methoxy-phenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [4-[(2,4-dichlorophenyl)methoxy]-3-methoxyphenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [4-(2,4-dichlorobenzyl)oxy-3-methoxy-phenyl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C21H25Cl2N2O3+ MolecularWeight: 424.3408

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)OCC3=C(C=C(C=C3)Cl)Cl)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=C(C=C2)OCC3=C(C=C(C=C3)Cl)Cl)OC

InChI

InChI=1S/C21H24Cl2N2O3/c1-3-24-8-10-25(11-9-24)21(26)15-5-7-19(20(12-15)27-2)28-14-16-4-6-17(22)13-18(16)23/h4-7,12-13H,3,8-11,14H2,1-2H3/p+1