[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-cyclopropyl-[(4-fluorophenyl)methyl]azanium

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]-cyclopropyl-[(4-fluorophenyl)methyl]azanium Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl]-cyclopropyl-[(4-fluorophenyl)methyl]ammonium CAS Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-cyclopropyl-[(4-fluorophenyl)methyl]ammonium IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl]-cyclopropyl-[(4-fluorophenyl)methyl]azanium Traditional Name: [2-(1-adamantylmethylamino)-2-keto-ethyl]-cyclopropyl-(4-fluorobenzyl)ammonium Formula: C23H32FN2O+ MolecularWeight: 371.511383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+](CC2=CC=C(C=C2)F)CC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC1[NH+](CC2=CC=C(C=C2)F)CC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H31FN2O/c24-20-3-1-16(2-4-20)13-26(21-5-6-21)14-22(27)25-15-23-10-17-7-18(11-23)9-19(8-17)12-23/h1-4,17-19,21H,5-15H2,(H,25,27)/p+1