(2R)-N-(3,4-dimethoxyphenyl)-2-(4-ethanoylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: (2R)-N-(3,4-dimethoxyphenyl)-2-(4-ethanoylpiperazin-1-ium-1-yl)propanamide Openeye Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(3,4-dimethoxyphenyl)propanamide CAS Name: (2R)-2-(4-acetyl-1-piperazin-1-iumyl)-N-(3,4-dimethoxyphenyl)propanamide IUPAC Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(3,4-dimethoxyphenyl)propanamide Traditional Name: (2R)-2-(4-acetylpiperazin-1-ium-1-yl)-N-(3,4-dimethoxyphenyl)propionamide Formula: C17H26N3O4+ MolecularWeight: 336.40604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)C(=O)C

InChI

InChI=1S/C17H25N3O4/c1-12(19-7-9-20(10-8-19)13(2)21)17(22)18-14-5-6-15(23-3)16(11-14)24-4/h5-6,11-12H,7-10H2,1-4H3,(H,18,22)/p+1/t12-/m1/s1