butyl-[(4R)-1-[(4-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-(phenylmethyl)azanium

Systemtic Name: butyl-[(4R)-1-[(4-fluorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-(phenylmethyl)azanium Openeye Name: benzyl-butyl-[(4R)-1-[(4-fluorophenyl)methyl]-7-oxo-azepan-4-yl]ammonium CAS Name: butyl-[(4R)-1-[(4-fluorophenyl)methyl]-7-oxo-4-azepanyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-butyl-[(4R)-1-[(4-fluorophenyl)methyl]-7-oxoazepan-4-yl]azanium Traditional Name: benzyl-butyl-[(4R)-1-(4-fluorobenzyl)-7-keto-azepan-4-yl]ammonium Formula: C24H32FN2O+ MolecularWeight: 383.522083

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC1=CC=CC=C1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCCC[NH+](CC1=CC=CC=C1)[C@@H]2CCC(=O)N(CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C24H31FN2O/c1-2-3-16-26(18-20-7-5-4-6-8-20)23-13-14-24(28)27(17-15-23)19-21-9-11-22(25)12-10-21/h4-12,23H,2-3,13-19H2,1H3/p+1/t23-/m1/s1