(2,4-dichlorophenyl) 4-[[bis(azanyl)methylideneamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: (2,4-dichlorophenyl) 4-[[bis(azanyl)methylideneamino]methyl]cyclohexane-1-carboxylate Openeye Name: (2,4-dichlorophenyl) 4-(guanidinomethyl)cyclohexanecarboxylate CAS Name: 4-[(diaminomethylideneamino)methyl]-1-cyclohexanecarboxylic acid (2,4-dichlorophenyl) ester IUPAC Name: (2,4-dichlorophenyl) 4-[(diaminomethylideneamino)methyl]cyclohexane-1-carboxylate Traditional Name: 4-(guanidinomethyl)cyclohexanecarboxylic acid (2,4-dichlorophenyl) ester Formula: C15H19Cl2N3O2 MolecularWeight: 344.23626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN=C(N)N)C(=O)OC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1CC(CCC1CN=C(N)N)C(=O)OC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C15H19Cl2N3O2/c16-11-5-6-13(12(17)7-11)22-14(21)10-3-1-9(2-4-10)8-20-15(18)19/h5-7,9-10H,1-4,8H2,(H4,18,19,20)