N-[bis(azanyl)methylideneamino]-2-[3,4-bis(oxidanyl)phenyl]ethanenitrilium

Systemtic Name: N-[bis(azanyl)methylideneamino]-2-[3,4-bis(oxidanyl)phenyl]ethanenitrilium Openeye Name: 2-(3,4-dihydroxyphenyl)-N-guanidino-acetonitrilium CAS Name: N-(diaminomethylideneamino)-2-(3,4-dihydroxyphenyl)acetonitrilium IUPAC Name: N-(diaminomethylideneamino)-2-(3,4-dihydroxyphenyl)acetonitrilium Traditional Name: 2-(3,4-dihydroxyphenyl)-N-guanidino-acetonitrilium Formula: C9H11N4O2+ MolecularWeight: 207.20924

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CC#[N+]N=C(N)N)O)O

Isomeric SMILES

C1=CC(=C(C=C1CC#[N+]N=C(N)N)O)O

InChI

InChI=1S/C9H10N4O2/c10-9(11)13-12-4-3-6-1-2-7(14)8(15)5-6/h1-2,5H,3H2,(H5-,10,11,13,14,15)/p+1