[(2R)-1-(4-methylpiperazine-1,4-diium-1-yl)propan-2-yl] 4-methoxybenzoate

Systemtic Name: [(2R)-1-(4-methylpiperazine-1,4-diium-1-yl)propan-2-yl] 4-methoxybenzoate Openeye Name: [(1R)-1-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [(2R)-1-(4-methyl-1-piperazine-1,4-diiumyl)propan-2-yl] ester IUPAC Name: [(2R)-1-(4-methylpiperazine-1,4-diium-1-yl)propan-2-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [(1R)-1-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl] ester Formula: C16H26N2O3+2 MolecularWeight: 294.38924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CC[NH+](CC1)C)OC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H](C[NH+]1CC[NH+](CC1)C)OC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H24N2O3/c1-13(12-18-10-8-17(2)9-11-18)21-16(19)14-4-6-15(20-3)7-5-14/h4-7,13H,8-12H2,1-3H3/p+2/t13-/m1/s1