2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(2-phenoxyethyl)ethanamide

Systemtic Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(2-phenoxyethyl)ethanamide Openeye Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(2-phenoxyethyl)acetamide CAS Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-(2-phenoxyethyl)acetamide IUPAC Name: 2-[(2R)-1-[(3,4-dimethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(2-phenoxyethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-veratryl-piperazin-1-ium-2-yl]-N-methyl-N-(2-phenoxyethyl)acetamide Formula: C24H32N3O5+ MolecularWeight: 442.52798

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC=C1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCOC1=CC=CC=C1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H31N3O5/c1-26(13-14-32-19-7-5-4-6-8-19)23(28)16-20-24(29)25-11-12-27(20)17-18-9-10-21(30-2)22(15-18)31-3/h4-10,15,20H,11-14,16-17H2,1-3H3,(H,25,29)/p+1/t20-/m1/s1