2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-1-ium-1-yl]methoxy]-3-phenyl-propanoic acid

Systemtic Name: 2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-1-ium-1-yl]methoxy]-3-phenyl-propanoic acid Openeye Name: 2-[(1-tert-butoxycarbonylpyrrolidin-1-ium-1-yl)methoxy]-3-phenyl-propanoic acid CAS Name: 2-[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-pyrrolidin-1-iumyl]methoxy]-3-phenylpropanoic acid IUPAC Name: 2-[[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-1-ium-1-yl]methoxy]-3-phenylpropanoic acid Traditional Name: 2-[(1-tert-butoxycarbonylpyrrolidin-1-ium-1-yl)methoxy]-3-phenyl-propionic acid Formula: C19H28NO5+ MolecularWeight: 350.42932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCCC1)COC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCCC1)COC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H27NO5/c1-19(2,3)25-18(23)20(11-7-8-12-20)14-24-16(17(21)22)13-15-9-5-4-6-10-15/h4-6,9-10,16H,7-8,11-14H2,1-3H3/p+1