N-(5-chloranyl-2-methoxy-phenyl)-4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(5-chloranyl-2-methoxy-phenyl)-4-[(5-chloranyl-2-methoxy-phenyl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(5-chloro-2-methoxy-phenyl)-4-[(5-chloro-2-methoxy-phenyl)methyl]piperazin-4-ium-1-carboxamide CAS Name: N-(5-chloro-2-methoxyphenyl)-4-[(5-chloro-2-methoxyphenyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(5-chloro-2-methoxyphenyl)-4-[(5-chloro-2-methoxyphenyl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-(5-chloro-2-methoxy-benzyl)-N-(5-chloro-2-methoxy-phenyl)piperazin-4-ium-1-carboxamide Formula: C20H24Cl2N3O3+ MolecularWeight: 425.32886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C[NH+]2CCN(CC2)C(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C[NH+]2CCN(CC2)C(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H23Cl2N3O3/c1-27-18-5-3-15(21)11-14(18)13-24-7-9-25(10-8-24)20(26)23-17-12-16(22)4-6-19(17)28-2/h3-6,11-12H,7-10,13H2,1-2H3,(H,23,26)/p+1