N-(1-adamantyl)methanamide; 2-[3-[4-[3-[bis(azanyl)methylideneamino]propyl]piperazin-1-yl]propyl]guanidine; dihydrochloride

Systemtic Name: N-(1-adamantyl)methanamide; 2-[3-[4-[3-[bis(azanyl)methylideneamino]propyl]piperazin-1-yl]propyl]guanidine; dihydrochloride Openeye Name: N-(1-adamantyl)formamide; 2-[3-[4-(3-guanidinopropyl)piperazin-1-yl]propyl]guanidine; dihydrochloride CAS Name: N-(1-adamantyl)formamide; 2-[3-[4-[3-(diaminomethylideneamino)propyl]-1-piperazinyl]propyl]guanidine; dihydrochloride IUPAC Name: N-(1-adamantyl)formamide; 2-[3-[4-[3-(diaminomethylideneamino)propyl]piperazin-1-yl]propyl]guanidine; dihydrochloride Traditional Name: N-(1-adamantyl)formamide; 2-[3-[4-(3-guanidinopropyl)piperazino]propyl]guanidine; dihydrochloride Formula: C23H47Cl2N9O MolecularWeight: 536.58498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN=C(N)N)CCCN=C(N)N.C1C2CC3CC1CC(C2)(C3)NC=O.Cl.Cl

Isomeric SMILES

C1CN(CCN1CCCN=C(N)N)CCCN=C(N)N.C1C2CC3CC1CC(C2)(C3)NC=O.Cl.Cl

InChI

InChI=1S/C12H28N8.C11H17NO.2ClH/c13-11(14)17-3-1-5-19-7-9-20(10-8-19)6-2-4-18-12(15)16;13-7-12-11-4-8-1-9(5-11)3-10(2-8)6-11;;/h1-10H2,(H4,13,14,17)(H4,15,16,18);7-10H,1-6H2,(H,12,13);2*1H