5-azanyl-2-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propylamino]benzenecarbonitrile

Systemtic Name: 5-azanyl-2-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propylamino]benzenecarbonitrile Openeye Name: 5-amino-2-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propylamino]benzonitrile CAS Name: 5-amino-2-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propylamino]benzonitrile IUPAC Name: 5-amino-2-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propylamino]benzonitrile Traditional Name: 5-amino-2-[3-(3-methyl-1H-imidazol-3-ium-2-yl)propylamino]benzonitrile Formula: C14H18N5+ MolecularWeight: 256.32622

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC=C1)CCCNC2=C(C=C(C=C2)N)C#N

Isomeric SMILES

C[N+]1=C(NC=C1)CCCNC2=C(C=C(C=C2)N)C#N

InChI

InChI=1S/C14H17N5/c1-19-8-7-18-14(19)3-2-6-17-13-5-4-12(16)9-11(13)10-15/h4-5,7-9,17H,2-3,6,16H2,1H3/p+1