[4-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]-3-oxidanyl-naphthalen-2-yl]-morpholin-4-yl-methanone

Systemtic Name: [4-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]-3-oxidanyl-naphthalen-2-yl]-morpholin-4-yl-methanone Openeye Name: [4-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]-3-hydroxy-2-naphthyl]-morpholino-methanone CAS Name: [4-[[4-(2-chlorophenyl)-1-piperazin-1-iumyl]methyl]-3-hydroxy-2-naphthalenyl]-(4-morpholinyl)methanone IUPAC Name: [4-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]-3-hydroxynaphthalen-2-yl]-morpholin-4-ylmethanone Traditional Name: [4-[[4-(2-chlorophenyl)piperazin-1-ium-1-yl]methyl]-3-hydroxy-2-naphthyl]-morpholino-methanone Formula: C26H29ClN3O3+ MolecularWeight: 466.97976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C(=CC3=CC=CC=C32)C(=O)N4CCOCC4)O)C5=CC=CC=C5Cl

InChI

InChI=1S/C26H28ClN3O3/c27-23-7-3-4-8-24(23)29-11-9-28(10-12-29)18-22-20-6-2-1-5-19(20)17-21(25(22)31)26(32)30-13-15-33-16-14-30/h1-8,17,31H,9-16,18H2/p+1