N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C16H24N3O4+ MolecularWeight: 322.37946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)OC)NC(=O)C[NH+]2CCNC(=O)C2

Isomeric SMILES

C[C@H](C1=C(C=CC(=C1)OC)OC)NC(=O)C[NH+]2CCNC(=O)C2

InChI

InChI=1S/C16H23N3O4/c1-11(13-8-12(22-2)4-5-14(13)23-3)18-16(21)10-19-7-6-17-15(20)9-19/h4-5,8,11H,6-7,9-10H2,1-3H3,(H,17,20)(H,18,21)/p+1/t11-/m1/s1