(2-methoxyphenyl) 4-[[bis(azanyl)methylideneamino]methyl]cyclohexane-1-carboxylate hydrochloride

Systemtic Name: (2-methoxyphenyl) 4-[[bis(azanyl)methylideneamino]methyl]cyclohexane-1-carboxylate hydrochloride Openeye Name: (2-methoxyphenyl) 4-(guanidinomethyl)cyclohexanecarboxylate hydrochloride CAS Name: 4-[(diaminomethylideneamino)methyl]-1-cyclohexanecarboxylic acid (2-methoxyphenyl) ester hydrochloride IUPAC Name: (2-methoxyphenyl) 4-[(diaminomethylideneamino)methyl]cyclohexane-1-carboxylate hydrochloride Traditional Name: 4-(guanidinomethyl)cyclohexanecarboxylic acid (2-methoxyphenyl) ester hydrochloride Formula: C16H24ClN3O3 MolecularWeight: 341.83306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC(=O)C2CCC(CC2)CN=C(N)N.Cl

Isomeric SMILES

COC1=CC=CC=C1OC(=O)C2CCC(CC2)CN=C(N)N.Cl

InChI

InChI=1S/C16H23N3O3.ClH/c1-21-13-4-2-3-5-14(13)22-15(20)12-8-6-11(7-9-12)10-19-16(17)18;/h2-5,11-12H,6-10H2,1H3,(H4,17,18,19);1H