2-[6-[bis(azanyl)methylideneamino]hexyl]guanidine; isocyanatomethylbenzene

Systemtic Name: 2-[6-[bis(azanyl)methylideneamino]hexyl]guanidine; isocyanatomethylbenzene Openeye Name: 2-(6-guanidinohexyl)guanidine; isocyanatomethylbenzene CAS Name: 2-[6-(diaminomethylideneamino)hexyl]guanidine; isocyanatomethylbenzene IUPAC Name: 2-[6-(diaminomethylideneamino)hexyl]guanidine; isocyanatomethylbenzene Traditional Name: 2-(6-guanidinohexyl)guanidine; isocyanatomethylbenzene Formula: C16H27N7O MolecularWeight: 333.43188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN=C=O.C(CCCN=C(N)N)CCN=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)CN=C=O.C(CCCN=C(N)N)CCN=C(N)N

InChI

InChI=1S/C8H20N6.C8H7NO/c9-7(10)13-5-3-1-2-4-6-14-8(11)12;10-7-9-6-8-4-2-1-3-5-8/h1-6H2,(H4,9,10,13)(H4,11,12,14);1-5H,6H2