(4-sulfamoylphenyl) 4-[[bis(azanyl)methylideneamino]methyl]cyclohexane-1-carboxylate

Systemtic Name: (4-sulfamoylphenyl) 4-[[bis(azanyl)methylideneamino]methyl]cyclohexane-1-carboxylate Openeye Name: (4-sulfamoylphenyl) 4-(guanidinomethyl)cyclohexanecarboxylate CAS Name: 4-[(diaminomethylideneamino)methyl]-1-cyclohexanecarboxylic acid (4-sulfamoylphenyl) ester IUPAC Name: (4-sulfamoylphenyl) 4-[(diaminomethylideneamino)methyl]cyclohexane-1-carboxylate Traditional Name: 4-(guanidinomethyl)cyclohexanecarboxylic acid (4-sulfamoylphenyl) ester Formula: C15H22N4O4S MolecularWeight: 354.42458

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN=C(N)N)C(=O)OC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1CC(CCC1CN=C(N)N)C(=O)OC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C15H22N4O4S/c16-15(17)19-9-10-1-3-11(4-2-10)14(20)23-12-5-7-13(8-6-12)24(18,21)22/h5-8,10-11H,1-4,9H2,(H4,16,17,19)(H2,18,21,22)