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

Systemtic Name: phenethyl-(phenylmethyl)-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: benzyl-phenethyl-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: phenethyl-(phenylmethyl)-[[3-(2-pyridinyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium IUPAC Name: benzyl-phenethyl-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: benzyl-phenethyl-[[3-(2-pyridyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C23H23N4O+ MolecularWeight: 371.45492

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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=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)CC[NH+](CC2=CC=CC=C2)CC3=NC(=NO3)C4=CC=CC=N4

InChI

InChI=1S/C23H22N4O/c1-3-9-19(10-4-1)14-16-27(17-20-11-5-2-6-12-20)18-22-25-23(26-28-22)21-13-7-8-15-24-21/h1-13,15H,14,16-18H2/p+1