N-(4-bromanyl-3-methyl-phenyl)-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-2-(4-pyrrolidin-1-ylcarbonylpiperidin-1-ium-1-yl)ethanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide CAS Name: N-(4-bromo-3-methylphenyl)-2-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(4-bromo-3-methylphenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-2-[4-(pyrrolidine-1-carbonyl)piperidin-1-ium-1-yl]acetamide Formula: C19H27BrN3O2+ MolecularWeight: 409.34058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)N3CCCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)N3CCCC3)Br

InChI

InChI=1S/C19H26BrN3O2/c1-14-12-16(4-5-17(14)20)21-18(24)13-22-10-6-15(7-11-22)19(25)23-8-2-3-9-23/h4-5,12,15H,2-3,6-11,13H2,1H3,(H,21,24)/p+1