[2,5-bis[(4-methoxyphenyl)methoxy]phenyl]-(4-chloranyl-1-methyl-piperazin-1-ium-1-yl)methanone

Systemtic Name: [2,5-bis[(4-methoxyphenyl)methoxy]phenyl]-(4-chloranyl-1-methyl-piperazin-1-ium-1-yl)methanone Openeye Name: [2,5-bis[(4-methoxyphenyl)methoxy]phenyl]-(4-chloro-1-methyl-piperazin-1-ium-1-yl)methanone CAS Name: [2,5-bis[(4-methoxyphenyl)methoxy]phenyl]-(4-chloro-1-methyl-1-piperazin-1-iumyl)methanone IUPAC Name: [2,5-bis[(4-methoxyphenyl)methoxy]phenyl]-(4-chloro-1-methylpiperazin-1-ium-1-yl)methanone Traditional Name: [2,5-bis(p-anisyloxy)phenyl]-(4-chloro-1-methyl-piperazin-1-ium-1-yl)methanone Formula: C28H32ClN2O5+ MolecularWeight: 512.01708

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)Cl)C(=O)C2=C(C=CC(=C2)OCC3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)OC

Isomeric SMILES

C[N+]1(CCN(CC1)Cl)C(=O)C2=C(C=CC(=C2)OCC3=CC=C(C=C3)OC)OCC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H32ClN2O5/c1-31(16-14-30(29)15-17-31)28(32)26-18-25(35-19-21-4-8-23(33-2)9-5-21)12-13-27(26)36-20-22-6-10-24(34-3)11-7-22/h4-13,18H,14-17,19-20H2,1-3H3/q+1