2-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethoxy]ethanoate

Systemtic Name: 2-[2-oxidanylidene-2-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]ethoxy]ethanoate Openeye Name: 2-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-oxo-2-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]ethoxy]acetate IUPAC Name: 2-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-[(1-benzylpiperidin-1-ium-4-yl)amino]-2-keto-ethoxy]acetate Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)COCC(=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1NC(=O)COCC(=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C16H22N2O4/c19-15(11-22-12-16(20)21)17-14-6-8-18(9-7-14)10-13-4-2-1-3-5-13/h1-5,14H,6-12H2,(H,17,19)(H,20,21)