dimethyl-[2-oxidanylidene-2-[(5S,7R)-3-phenyl-1-adamantyl]ethyl]azanium

Systemtic Name: dimethyl-[2-oxidanylidene-2-[(5S,7R)-3-phenyl-1-adamantyl]ethyl]azanium Openeye Name: dimethyl-[2-oxo-2-[(5S,7R)-3-phenyl-1-adamantyl]ethyl]ammonium CAS Name: dimethyl-[2-oxo-2-[(5S,7R)-3-phenyl-1-adamantyl]ethyl]ammonium IUPAC Name: dimethyl-[2-oxo-2-[(5S,7R)-3-phenyl-1-adamantyl]ethyl]azanium Traditional Name: [2-keto-2-[(5S,7R)-3-phenyl-1-adamantyl]ethyl]-dimethyl-ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC(=O)C12CC3CC(C1)CC(C3)(C2)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)CC(=O)C12C[C@@H]3C[C@H](C1)CC(C3)(C2)C4=CC=CC=C4

InChI

InChI=1S/C20H27NO/c1-21(2)13-18(22)20-11-15-8-16(12-20)10-19(9-15,14-20)17-6-4-3-5-7-17/h3-7,15-16H,8-14H2,1-2H3/p+1/t15-,16+,19?,20?