3-chloranyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-4-oxidanyl-benzamide

Systemtic Name: 3-chloranyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-4-oxidanyl-benzamide Openeye Name: 3-chloro-4-hydroxy-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide CAS Name: 3-chloro-4-hydroxy-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]benzamide IUPAC Name: 3-chloro-4-hydroxy-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Traditional Name: 3-chloro-4-hydroxy-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzamide Formula: C16H24ClN2O2+ MolecularWeight: 311.82696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC(=C(C=C2)O)Cl

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC(=C(C=C2)O)Cl

InChI

InChI=1S/C16H23ClN2O2/c1-12-5-2-3-9-19(12)10-4-8-18-16(21)13-6-7-15(20)14(17)11-13/h6-7,11-12,20H,2-5,8-10H2,1H3,(H,18,21)/p+1/t12-/m0/s1