[3-(dimethylamino)phenyl]-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [3-(dimethylamino)phenyl]-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [3-(dimethylamino)phenyl]-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone CAS Name: [3-(dimethylamino)phenyl]-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [3-(dimethylamino)phenyl]-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [3-(dimethylamino)phenyl]-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]methanone Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CCOC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H27N3O2/c1-22(2)19-8-6-7-18(17-19)21(25)24-13-11-23(12-14-24)15-16-26-20-9-4-3-5-10-20/h3-10,17H,11-16H2,1-2H3/p+1