[3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylindol-1-yl]methyl-dimethyl-azanium

Systemtic Name: [3-[4-(3-chlorophenyl)piperazin-1-yl]carbonylindol-1-yl]methyl-dimethyl-azanium Openeye Name: [3-[4-(3-chlorophenyl)piperazine-1-carbonyl]indol-1-yl]methyl-dimethyl-ammonium CAS Name: [3-[[4-(3-chlorophenyl)-1-piperazinyl]-oxomethyl]-1-indolyl]methyl-dimethylammonium IUPAC Name: [3-[4-(3-chlorophenyl)piperazine-1-carbonyl]indol-1-yl]methyl-dimethylazanium Traditional Name: [3-[4-(3-chlorophenyl)piperazine-1-carbonyl]indol-1-yl]methyl-dimethyl-ammonium Formula: C22H26ClN4O+ MolecularWeight: 397.92104

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CN1C=C(C2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C[NH+](C)CN1C=C(C2=CC=CC=C21)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O/c1-24(2)16-27-15-20(19-8-3-4-9-21(19)27)22(28)26-12-10-25(11-13-26)18-7-5-6-17(23)14-18/h3-9,14-15H,10-13,16H2,1-2H3/p+1