5-bromanyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-yl-ethyl]pyridine-3-carboxamide Openeye Name: 5-bromo-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]pyridine-3-carboxamide CAS Name: 5-bromo-N-[(1R)-1-(4-methylphenyl)-2-(4-morpholin-4-iumyl)ethyl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-[(1R)-1-(4-methylphenyl)-2-morpholin-4-ium-4-ylethyl]pyridine-3-carboxamide Traditional Name: 5-bromo-N-[(1R)-2-morpholin-4-ium-4-yl-1-(p-tolyl)ethyl]nicotinamide Formula: C19H23BrN3O2+ MolecularWeight: 405.30882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C[NH+]2CCOCC2)NC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C[NH+]2CCOCC2)NC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C19H22BrN3O2/c1-14-2-4-15(5-3-14)18(13-23-6-8-25-9-7-23)22-19(24)16-10-17(20)12-21-11-16/h2-5,10-12,18H,6-9,13H2,1H3,(H,22,24)/p+1/t18-/m0/s1