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

Systemtic Name: (2R)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Openeye Name: (2R)-2-[4-[(4,5-dimethoxy-2-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]propanamide CAS Name: (2R)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]propanamide IUPAC Name: (2R)-2-[4-[(4,5-dimethoxy-2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]propanamide Traditional Name: (2R)-2-[4-(4,5-dimethoxy-2-methyl-benzyl)piperazine-1,4-diium-1-yl]propionamide Formula: C17H29N3O3+2 MolecularWeight: 323.43046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1C[NH+]2CC[NH+](CC2)[C@H](C)C(=O)N)OC)OC

InChI

InChI=1S/C17H27N3O3/c1-12-9-15(22-3)16(23-4)10-14(12)11-19-5-7-20(8-6-19)13(2)17(18)21/h9-10,13H,5-8,11H2,1-4H3,(H2,18,21)/p+2/t13-/m1/s1