[(4R)-1-[(4-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-(2-methylpropyl)azanium

Systemtic Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-(2-methylpropyl)azanium Openeye Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxo-azepan-4-yl]-isobutyl-methyl-ammonium CAS Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxo-4-azepanyl]-methyl-(2-methylpropyl)ammonium IUPAC Name: [(4R)-1-[(4-fluorophenyl)methyl]-7-oxoazepan-4-yl]-methyl-(2-methylpropyl)azanium Traditional Name: [(4R)-1-(4-fluorobenzyl)-7-keto-azepan-4-yl]-isobutyl-methyl-ammonium Formula: C18H28FN2O+ MolecularWeight: 307.426123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+](C)C1CCC(=O)N(CC1)CC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)C[NH+](C)[C@@H]1CCC(=O)N(CC1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H27FN2O/c1-14(2)12-20(3)17-8-9-18(22)21(11-10-17)13-15-4-6-16(19)7-5-15/h4-7,14,17H,8-13H2,1-3H3/p+1/t17-/m1/s1