4-(4-hydroxyphenyl)-N-[2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethyl]benzamide

Systemtic Name: 4-(4-hydroxyphenyl)-N-[2-[(3S)-3-oxidanylpiperidin-1-ium-1-yl]ethyl]benzamide Openeye Name: 4-(4-hydroxyphenyl)-N-[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]ethyl]benzamide CAS Name: 4-(4-hydroxyphenyl)-N-[2-[(3S)-3-hydroxy-1-piperidin-1-iumyl]ethyl]benzamide IUPAC Name: 4-(4-hydroxyphenyl)-N-[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]ethyl]benzamide Traditional Name: 4-(4-hydroxyphenyl)-N-[2-[(3S)-3-hydroxypiperidin-1-ium-1-yl]ethyl]benzamide Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CCNC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)O)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CCNC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)O)O

InChI

InChI=1S/C20H24N2O3/c23-18-9-7-16(8-10-18)15-3-5-17(6-4-15)20(25)21-11-13-22-12-1-2-19(24)14-22/h3-10,19,23-24H,1-2,11-14H2,(H,21,25)/p+1/t19-/m0/s1