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

Systemtic Name: N-cyclopropyl-2-[4-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-[[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-[(3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-ium-1-yl]acetamide Formula: C21H30N5O2+ MolecularWeight: 384.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CN3CC[NH+](CC3)CC(=O)NC4CC4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CN3CC[NH+](CC3)CC(=O)NC4CC4

InChI

InChI=1S/C21H29N5O2/c1-15(2)16-3-5-17(6-4-16)21-23-20(28-24-21)14-26-11-9-25(10-12-26)13-19(27)22-18-7-8-18/h3-6,15,18H,7-14H2,1-2H3,(H,22,27)/p+1