(3-chlorophenyl)methyl-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-methyl-azanium

Systemtic Name: (3-chlorophenyl)methyl-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-methyl-azanium Openeye Name: (3-chlorophenyl)methyl-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]-methyl-ammonium CAS Name: (3-chlorophenyl)methyl-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-methylammonium IUPAC Name: (3-chlorophenyl)methyl-[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-methylazanium Traditional Name: (3-chlorobenzyl)-[3-keto-3-[4-(4-methoxyphenyl)piperazino]propyl]-methyl-ammonium Formula: C22H29ClN3O2+ MolecularWeight: 402.93756

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C[NH+](CCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H28ClN3O2/c1-24(17-18-4-3-5-19(23)16-18)11-10-22(27)26-14-12-25(13-15-26)20-6-8-21(28-2)9-7-20/h3-9,16H,10-15,17H2,1-2H3/p+1