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

Systemtic Name: (2R)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethyl-propanamide Openeye Name: (2R)-2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethyl-propanamide CAS Name: (2R)-2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N,N-dimethylpropanamide IUPAC Name: (2R)-2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N,N-dimethylpropanamide Traditional Name: (2R)-2-[4-(2-methoxy-5-methyl-benzyl)piperazine-1,4-diium-1-yl]-N,N-dimethyl-propionamide Formula: C18H31N3O2+2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)C(C)C(=O)N(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)[C@H](C)C(=O)N(C)C

InChI

InChI=1S/C18H29N3O2/c1-14-6-7-17(23-5)16(12-14)13-20-8-10-21(11-9-20)15(2)18(22)19(3)4/h6-7,12,15H,8-11,13H2,1-5H3/p+2/t15-/m1/s1