5-[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]pentylazanium

Systemtic Name: 5-[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]pentylazanium Openeye Name: 5-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]pentylammonium CAS Name: 5-[3-(4-oxo-1-cyclohexa-2,5-dienylidene)-1,2,4-oxadiazol-5-yl]pentylammonium IUPAC Name: 5-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]pentylazanium Traditional Name: 5-[3-(4-ketocyclohexa-2,5-dien-1-ylidene)-1,2,4-oxadiazol-5-yl]pentylammonium Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2NOC(=N2)CCCCC[NH3+]

Isomeric SMILES

C1=CC(=O)C=CC1=C2NOC(=N2)CCCCC[NH3+]

InChI

InChI=1S/C13H17N3O2/c14-9-3-1-2-4-12-15-13(16-18-12)10-5-7-11(17)8-6-10/h5-8,16H,1-4,9,14H2/p+1