N-[4-[[4-(4-pyrrolidin-1-ylcarbonylphenoxy)piperidin-1-ium-1-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(4-pyrrolidin-1-ylcarbonylphenoxy)piperidin-1-ium-1-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-[4-(pyrrolidine-1-carbonyl)phenoxy]piperidin-1-ium-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-[4-[oxo(1-pyrrolidinyl)methyl]phenoxy]-1-piperidin-1-iumyl]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-[4-(pyrrolidine-1-carbonyl)phenoxy]piperidin-1-ium-1-yl]methyl]phenyl]acetamide Traditional Name: N-[4-[[4-[4-(pyrrolidine-1-carbonyl)phenoxy]piperidin-1-ium-1-yl]methyl]phenyl]acetamide Formula: C25H32N3O3+ MolecularWeight: 422.53988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C25H31N3O3/c1-19(29)26-22-8-4-20(5-9-22)18-27-16-12-24(13-17-27)31-23-10-6-21(7-11-23)25(30)28-14-2-3-15-28/h4-11,24H,2-3,12-18H2,1H3,(H,26,29)/p+1