5-bromanyl-2-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 5-bromo-2-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 5-bromo-2-methoxy-N-[4-(1-piperidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 5-bromo-2-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 5-bromo-2-methoxy-N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C20H24BrN2O2+ MolecularWeight: 404.32076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C20H23BrN2O2/c1-25-19-10-7-16(21)13-18(19)20(24)22-17-8-5-15(6-9-17)14-23-11-3-2-4-12-23/h5-10,13H,2-4,11-12,14H2,1H3,(H,22,24)/p+1