1-[bis(azanyl)methylideneamino]-1-(4-chloranyl-2-hexyl-phenyl)guanidine; 1-[bis(azanyl)methylideneamino]-1-(4-chlorophenyl)guanidine

Systemtic Name: 1-[bis(azanyl)methylideneamino]-1-(4-chloranyl-2-hexyl-phenyl)guanidine; 1-[bis(azanyl)methylideneamino]-1-(4-chlorophenyl)guanidine Openeye Name: 1-(4-chloro-2-hexyl-phenyl)-1-guanidino-guanidine; 1-(4-chlorophenyl)-1-guanidino-guanidine CAS Name: 1-(4-chloro-2-hexylphenyl)-1-(diaminomethylideneamino)guanidine; 1-(4-chlorophenyl)-1-(diaminomethylideneamino)guanidine IUPAC Name: 1-(4-chloro-2-hexylphenyl)-1-(diaminomethylideneamino)guanidine; 1-(4-chlorophenyl)-1-(diaminomethylideneamino)guanidine Traditional Name: 1-(4-chloro-2-hexyl-phenyl)-1-guanidino-guanidine; 1-(4-chlorophenyl)-1-guanidino-guanidine Formula: C22H34Cl2N12 MolecularWeight: 537.49176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC(=C1)Cl)N(C(=N)N)N=C(N)N.C1=CC(=CC=C1N(C(=N)N)N=C(N)N)Cl

Isomeric SMILES

CCCCCCC1=C(C=CC(=C1)Cl)N(C(=N)N)N=C(N)N.C1=CC(=CC=C1N(C(=N)N)N=C(N)N)Cl

InChI

InChI=1S/C14H23ClN6.C8H11ClN6/c1-2-3-4-5-6-10-9-11(15)7-8-12(10)21(14(18)19)20-13(16)17;9-5-1-3-6(4-2-5)15(8(12)13)14-7(10)11/h7-9H,2-6H2,1H3,(H3,18,19)(H4,16,17,20);1-4H,(H3,12,13)(H4,10,11,14)