(2S)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-propanamide Openeye Name: (2S)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethyl-propanamide CAS Name: (2S)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-ethylpropanamide IUPAC Name: (2S)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-ethylpropanamide Traditional Name: (2S)-2-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazine-1,4-diium-1-yl]-N-ethyl-propionamide Formula: C19H33N3O3+2 MolecularWeight: 351.48362

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)[NH+]1CC[NH+](CC1)CC2=CC(=C(C=C2C)OC)OC

Isomeric SMILES

CCNC(=O)[C@H](C)[NH+]1CC[NH+](CC1)CC2=CC(=C(C=C2C)OC)OC

InChI

InChI=1S/C19H31N3O3/c1-6-20-19(23)15(3)22-9-7-21(8-10-22)13-16-12-18(25-5)17(24-4)11-14(16)2/h11-12,15H,6-10,13H2,1-5H3,(H,20,23)/p+2/t15-/m0/s1