2-[[(4R)-1-[(4-chlorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-ethyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[(4R)-1-[(4-chlorophenyl)methyl]-7-oxidanylidene-azepan-4-yl]-ethyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[[(4R)-1-[(4-chlorophenyl)methyl]-7-oxo-azepan-4-yl]-ethyl-amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(4R)-1-[(4-chlorophenyl)methyl]-7-oxo-4-azepanyl]-ethylamino]ethyl-dimethylammonium IUPAC Name: 2-[[(4R)-1-[(4-chlorophenyl)methyl]-7-oxoazepan-4-yl]-ethylamino]ethyl-dimethylazanium Traditional Name: 2-[[(4R)-1-(4-chlorobenzyl)-7-keto-azepan-4-yl]-ethyl-amino]ethyl-dimethyl-ammonium Formula: C19H31ClN3O+ MolecularWeight: 352.92194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30ClN3O/c1-4-22(14-13-21(2)3)18-9-10-19(24)23(12-11-18)15-16-5-7-17(20)8-6-16/h5-8,18H,4,9-15H2,1-3H3/p+1/t18-/m1/s1