(3-methoxyphenyl)-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-methoxyphenyl)-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-methoxyphenyl)-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-methoxyphenyl)-[4-[[3-(2-pyrazinyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-methoxyphenyl)-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-methoxyphenyl)-[4-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone Formula: C19H21N6O3+ MolecularWeight: 381.40844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=NC(=NO3)C4=NC=CN=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=NC(=NO3)C4=NC=CN=C4

InChI

InChI=1S/C19H20N6O3/c1-27-15-4-2-3-14(11-15)19(26)25-9-7-24(8-10-25)13-17-22-18(23-28-17)16-12-20-5-6-21-16/h2-6,11-12H,7-10,13H2,1H3/p+1