phenethyl-(phenylmethyl)-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium

Systemtic Name: phenethyl-(phenylmethyl)-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: benzyl-phenethyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ammonium CAS Name: phenethyl-(phenylmethyl)-[[3-(2-pyrazinyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium IUPAC Name: benzyl-phenethyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: benzyl-phenethyl-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ammonium Formula: C22H22N5O+ MolecularWeight: 372.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC[NH+](CC2=CC=CC=C2)CC3=NC(=NO3)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)CC[NH+](CC2=CC=CC=C2)CC3=NC(=NO3)C4=NC=CN=C4

InChI

InChI=1S/C22H21N5O/c1-3-7-18(8-4-1)11-14-27(16-19-9-5-2-6-10-19)17-21-25-22(26-28-21)20-15-23-12-13-24-20/h1-10,12-13,15H,11,14,16-17H2/p+1