[4-(azepan-1-ium-1-yl)piperidin-1-yl]-(2-chlorophenyl)methanone

Systemtic Name: [4-(azepan-1-ium-1-yl)piperidin-1-yl]-(2-chlorophenyl)methanone Openeye Name: [4-(azepan-1-ium-1-yl)-1-piperidyl]-(2-chlorophenyl)methanone CAS Name: [4-(1-azepan-1-iumyl)-1-piperidinyl]-(2-chlorophenyl)methanone IUPAC Name: [4-(azepan-1-ium-1-yl)piperidin-1-yl]-(2-chlorophenyl)methanone Traditional Name: [4-(azepan-1-ium-1-yl)piperidino]-(2-chlorophenyl)methanone Formula: C18H26ClN2O+ MolecularWeight: 321.86484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CCC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H25ClN2O/c19-17-8-4-3-7-16(17)18(22)21-13-9-15(10-14-21)20-11-5-1-2-6-12-20/h3-4,7-8,15H,1-2,5-6,9-14H2/p+1