[3-[[6-(1-adamantylamino)pyridin-1-ium-3-yl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[6-(1-adamantylamino)pyridin-1-ium-3-yl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[[6-(1-adamantylamino)pyridin-1-ium-3-yl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[6-(1-adamantylamino)-3-pyridin-1-iumyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[6-(1-adamantylamino)pyridin-1-ium-3-yl]amino]-3-oxopropyl]azanium Traditional Name: [3-[[6-(1-adamantylamino)pyridin-1-ium-3-yl]amino]-3-keto-propyl]ammonium Formula: C18H28N4O+2 MolecularWeight: 316.44112

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=[NH+]C=C(C=C4)NC(=O)CC[NH3+]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=[NH+]C=C(C=C4)NC(=O)CC[NH3+]

InChI

InChI=1S/C18H26N4O/c19-4-3-17(23)21-15-1-2-16(20-11-15)22-18-8-12-5-13(9-18)7-14(6-12)10-18/h1-2,11-14H,3-10,19H2,(H,20,22)(H,21,23)/p+2