bis(azanyl)methylidene-[[(E)-(5-tert-butylpyrrol-2-ylidene)methyl]-phenyl-amino]azanium

Systemtic Name: bis(azanyl)methylidene-[[(E)-(5-tert-butylpyrrol-2-ylidene)methyl]-phenyl-amino]azanium Openeye Name: (N-[(E)-(5-tert-butylpyrrol-2-ylidene)methyl]anilino)-(diaminomethylene)ammonium CAS Name: (N-[(E)-(5-tert-butyl-2-pyrrolylidene)methyl]anilino)-(diaminomethylidene)ammonium IUPAC Name: (N-[(E)-(5-tert-butylpyrrol-2-ylidene)methyl]anilino)-(diaminomethylidene)azanium Traditional Name: (N-[(E)-(5-tert-butylpyrrol-2-ylidene)methyl]anilino)-(diaminomethylene)ammonium Formula: C16H22N5+ MolecularWeight: 284.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=CN(C2=CC=CC=C2)[NH+]=C(N)N)C=C1

Isomeric SMILES

CC(C)(C)C1=N/C(=C/N(C2=CC=CC=C2)[NH+]=C(N)N)/C=C1

InChI

InChI=1S/C16H21N5/c1-16(2,3)14-10-9-12(19-14)11-21(20-15(17)18)13-7-5-4-6-8-13/h4-11H,1-3H3,(H4,17,18,20)/p+1/b12-11+