N-(3-methoxypropyl)-2-[4-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-(3-methoxypropyl)-2-[4-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: 2-[4-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)acetamide CAS Name: 2-[4-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[4-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)acetamide Traditional Name: 2-[4-(2-hydroxy-5-isopropyl-4-methyl-benzyl)piperazine-1,4-diium-1-yl]-N-(3-methoxypropyl)acetamide Formula: C21H37N3O3+2 MolecularWeight: 379.53678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N3O3/c1-16(2)19-13-18(20(25)12-17(19)3)14-23-7-9-24(10-8-23)15-21(26)22-6-5-11-27-4/h12-13,16,25H,5-11,14-15H2,1-4H3,(H,22,26)/p+2