2-[4-[(4-aminocarbonylpiperidin-1-ium-1-yl)methyl]phenyl]ethanoate

Systemtic Name: 2-[4-[(4-aminocarbonylpiperidin-1-ium-1-yl)methyl]phenyl]ethanoate Openeye Name: 2-[4-[(4-carbamoylpiperidin-1-ium-1-yl)methyl]phenyl]acetate CAS Name: 2-[4-[(4-carbamoyl-1-piperidin-1-iumyl)methyl]phenyl]acetate IUPAC Name: 2-[4-[(4-carbamoylpiperidin-1-ium-1-yl)methyl]phenyl]acetate Traditional Name: 2-[4-[(4-carbamoylpiperidin-1-ium-1-yl)methyl]phenyl]acetate Formula: C15H20N2O3 MolecularWeight: 276.3309

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC2=CC=C(C=C2)CC(=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC2=CC=C(C=C2)CC(=O)[O-]

InChI

InChI=1S/C15H20N2O3/c16-15(20)13-5-7-17(8-6-13)10-12-3-1-11(2-4-12)9-14(18)19/h1-4,13H,5-10H2,(H2,16,20)(H,18,19)