(5R)-1-[(4-chlorophenyl)methyl]-5-piperidin-1-ium-1-yl-azepan-2-one

Systemtic Name: (5R)-1-[(4-chlorophenyl)methyl]-5-piperidin-1-ium-1-yl-azepan-2-one Openeye Name: (5R)-1-[(4-chlorophenyl)methyl]-5-piperidin-1-ium-1-yl-azepan-2-one CAS Name: (5R)-1-[(4-chlorophenyl)methyl]-5-(1-piperidin-1-iumyl)-2-azepanone IUPAC Name: (5R)-1-[(4-chlorophenyl)methyl]-5-piperidin-1-ium-1-ylazepan-2-one Traditional Name: (5R)-1-(4-chlorobenzyl)-5-piperidin-1-ium-1-yl-azepan-2-one Formula: C18H26ClN2O+ MolecularWeight: 321.86484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2CCC(=O)N(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC[NH+](CC1)[C@@H]2CCC(=O)N(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H25ClN2O/c19-16-6-4-15(5-7-16)14-21-13-10-17(8-9-18(21)22)20-11-2-1-3-12-20/h4-7,17H,1-3,8-14H2/p+1/t17-/m1/s1