2-[4-[(4,5-dimethyl-2-oxidanyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholin-4-yl-ethanone

Systemtic Name: 2-[4-[(4,5-dimethyl-2-oxidanyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholin-4-yl-ethanone Openeye Name: 2-[4-[(2-hydroxy-4,5-dimethyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholino-ethanone CAS Name: 2-[4-[(2-hydroxy-4,5-dimethylphenyl)methyl]-1-piperazine-1,4-diiumyl]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[4-[(2-hydroxy-4,5-dimethylphenyl)methyl]piperazine-1,4-diium-1-yl]-1-morpholin-4-ylethanone Traditional Name: 2-[4-(2-hydroxy-4,5-dimethyl-benzyl)piperazine-1,4-diium-1-yl]-1-morpholino-ethanone Formula: C19H31N3O3+2 MolecularWeight: 349.46774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)O)C[NH+]2CC[NH+](CC2)CC(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1C)O)C[NH+]2CC[NH+](CC2)CC(=O)N3CCOCC3

InChI

InChI=1S/C19H29N3O3/c1-15-11-17(18(23)12-16(15)2)13-20-3-5-21(6-4-20)14-19(24)22-7-9-25-10-8-22/h11-12,23H,3-10,13-14H2,1-2H3/p+2