3-[(2-bromanylphenoxy)methyl]-4-methoxy-N-[3-(morpholin-4-ium-4-ylmethyl)phenyl]benzamide

Systemtic Name: 3-[(2-bromanylphenoxy)methyl]-4-methoxy-N-[3-(morpholin-4-ium-4-ylmethyl)phenyl]benzamide Openeye Name: 3-[(2-bromophenoxy)methyl]-4-methoxy-N-[3-(morpholin-4-ium-4-ylmethyl)phenyl]benzamide CAS Name: 3-[(2-bromophenoxy)methyl]-4-methoxy-N-[3-(4-morpholin-4-iumylmethyl)phenyl]benzamide IUPAC Name: 3-[(2-bromophenoxy)methyl]-4-methoxy-N-[3-(morpholin-4-ium-4-ylmethyl)phenyl]benzamide Traditional Name: 3-[(2-bromophenoxy)methyl]-4-methoxy-N-[3-(morpholin-4-ium-4-ylmethyl)phenyl]benzamide Formula: C26H28BrN2O4+ MolecularWeight: 512.41552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C[NH+]3CCOCC3)COC4=CC=CC=C4Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)C[NH+]3CCOCC3)COC4=CC=CC=C4Br

InChI

InChI=1S/C26H27BrN2O4/c1-31-24-10-9-20(16-21(24)18-33-25-8-3-2-7-23(25)27)26(30)28-22-6-4-5-19(15-22)17-29-11-13-32-14-12-29/h2-10,15-16H,11-14,17-18H2,1H3,(H,28,30)/p+1