[(4S)-azepan-1-ium-4-yl]-[4-(4-chloranylphenoxy)piperidin-1-yl]methanone

Systemtic Name: [(4S)-azepan-1-ium-4-yl]-[4-(4-chloranylphenoxy)piperidin-1-yl]methanone Openeye Name: [(4S)-azepan-1-ium-4-yl]-[4-(4-chlorophenoxy)-1-piperidyl]methanone CAS Name: [(4S)-4-azepan-1-iumyl]-[4-(4-chlorophenoxy)-1-piperidinyl]methanone IUPAC Name: [(4S)-azepan-1-ium-4-yl]-[4-(4-chlorophenoxy)piperidin-1-yl]methanone Traditional Name: [(4S)-azepan-1-ium-4-yl]-[4-(4-chlorophenoxy)piperidino]methanone Formula: C18H26ClN2O2+ MolecularWeight: 337.86424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC[NH2+]C1)C(=O)N2CCC(CC2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](CC[NH2+]C1)C(=O)N2CCC(CC2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H25ClN2O2/c19-15-3-5-16(6-4-15)23-17-8-12-21(13-9-17)18(22)14-2-1-10-20-11-7-14/h3-6,14,17,20H,1-2,7-13H2/p+1/t14-/m0/s1