[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-(phenylmethyl)azanium

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-(phenylmethyl)azanium Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl]-benzyl-ammonium CAS Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-(phenylmethyl)ammonium IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-benzylazanium Traditional Name: [2-(1-adamantylmethylamino)-2-keto-ethyl]-benzyl-ammonium Formula: C20H29N2O+ MolecularWeight: 313.45706

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C[NH2+]CC4=CC=CC=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C[NH2+]CC4=CC=CC=C4

InChI

InChI=1S/C20H28N2O/c23-19(13-21-12-15-4-2-1-3-5-15)22-14-20-9-16-6-17(10-20)8-18(7-16)11-20/h1-5,16-18,21H,6-14H2,(H,22,23)/p+1