(1E)-1-[azanyl-[(4-chlorophenyl)amino]methylidene]-2-propan-2-yl-guanidine ethanoate

Systemtic Name: (1E)-1-[azanyl-[(4-chlorophenyl)amino]methylidene]-2-propan-2-yl-guanidine ethanoate Openeye Name: (1E)-1-[amino-(4-chloroanilino)methylene]-2-isopropyl-guanidine acetate CAS Name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine acetate IUPAC Name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine acetate Traditional Name: (1E)-1-[amino-(4-chloroanilino)methylene]-2-isopropyl-guanidine acetate Formula: C13H19ClN5O2- MolecularWeight: 312.77526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(N)N=C(N)NC1=CC=C(C=C1)Cl.CC(=O)[O-]

Isomeric SMILES

CC(C)N=C(N)/N=C(\N)/NC1=CC=C(C=C1)Cl.CC(=O)[O-]

InChI

InChI=1S/C11H16ClN5.C2H4O2/c1-7(2)15-10(13)17-11(14)16-9-5-3-8(12)4-6-9;1-2(3)4/h3-7H,1-2H3,(H5,13,14,15,16,17);1H3,(H,3,4)/p-1