2-(4,7-dimethyl-1-propanoyl-quinazolin-1-ium-2-yl)guanidine

Systemtic Name: 2-(4,7-dimethyl-1-propanoyl-quinazolin-1-ium-2-yl)guanidine Openeye Name: 2-(4,7-dimethyl-1-propanoyl-quinazolin-1-ium-2-yl)guanidine CAS Name: 2-[4,7-dimethyl-1-(1-oxopropyl)-2-quinazolin-1-iumyl]guanidine IUPAC Name: 2-(4,7-dimethyl-1-propanoylquinazolin-1-ium-2-yl)guanidine Traditional Name: 2-(4,7-dimethyl-1-propionyl-quinazolin-1-ium-2-yl)guanidine Formula: C14H18N5O+ MolecularWeight: 272.32562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)[N+]1=C(N=C(C2=C1C=C(C=C2)C)C)N=C(N)N

Isomeric SMILES

CCC(=O)[N+]1=C(N=C(C2=C1C=C(C=C2)C)C)N=C(N)N

InChI

InChI=1S/C14H17N5O/c1-4-12(20)19-11-7-8(2)5-6-10(11)9(3)17-14(19)18-13(15)16/h5-7H,4H2,1-3H3,(H3,15,16)/p+1