[(4R)-1-[(3-chlorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-phenethyl-azanium

Systemtic Name: [(4R)-1-[(3-chlorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-methyl-phenethyl-azanium Openeye Name: [(4R)-1-[(3-chlorophenyl)methyl]-7-oxo-azepan-4-yl]-methyl-phenethyl-ammonium CAS Name: [(4R)-1-[(3-chlorophenyl)methyl]-7-oxo-4-azepanyl]-methyl-phenethylammonium IUPAC Name: [(4R)-1-[(3-chlorophenyl)methyl]-7-oxoazepan-4-yl]-methyl-phenethylazanium Traditional Name: [(4R)-1-(3-chlorobenzyl)-7-keto-azepan-4-yl]-methyl-phenethyl-ammonium Formula: C22H28ClN2O+ MolecularWeight: 371.92352

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC1=CC=CC=C1)C2CCC(=O)N(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C[NH+](CCC1=CC=CC=C1)[C@@H]2CCC(=O)N(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H27ClN2O/c1-24(14-12-18-6-3-2-4-7-18)21-10-11-22(26)25(15-13-21)17-19-8-5-9-20(23)16-19/h2-9,16,21H,10-15,17H2,1H3/p+1/t21-/m1/s1