N-(3-ethanoylphenyl)-2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-ethanoylphenyl)-2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(3-acetylphenyl)-2-[4-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(3-acetylphenyl)-2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(3-acetylphenyl)-2-[4-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-ium-1-yl]acetamide Formula: C20H28N5O3+ MolecularWeight: 386.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC(C)C1=NOC(=N1)CN2CC[NH+](CC2)CC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C20H27N5O3/c1-14(2)20-22-19(28-23-20)13-25-9-7-24(8-10-25)12-18(27)21-17-6-4-5-16(11-17)15(3)26/h4-6,11,14H,7-10,12-13H2,1-3H3,(H,21,27)/p+1