1-[5-(3-chlorophenyl)-1H-pyrrol-2-yl]-4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium

Systemtic Name: 1-[5-(3-chlorophenyl)-1H-pyrrol-2-yl]-4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium Openeye Name: 1-[5-(3-chlorophenyl)-1H-pyrrol-2-yl]-4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium CAS Name: 1-[5-(3-chlorophenyl)-1H-pyrrol-2-yl]-4-(2-methoxyphenyl)-1-methylpiperazin-1-ium IUPAC Name: 1-[5-(3-chlorophenyl)-1H-pyrrol-2-yl]-4-(2-methoxyphenyl)-1-methylpiperazin-1-ium Traditional Name: 1-[5-(3-chlorophenyl)-1H-pyrrol-2-yl]-4-(2-methoxyphenyl)-1-methyl-piperazin-1-ium Formula: C22H25ClN3O+ MolecularWeight: 382.9064

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C2=CC=CC=C2OC)C3=CC=C(N3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C[N+]1(CCN(CC1)C2=CC=CC=C2OC)C3=CC=C(N3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClN3O/c1-26(22-11-10-19(24-22)17-6-5-7-18(23)16-17)14-12-25(13-15-26)20-8-3-4-9-21(20)27-2/h3-11,16,24H,12-15H2,1-2H3/q+1