2-[3-(1-hydroxyethyl)-4-(4-methoxy-3-oxidanyl-phenyl)-3-methyl-pyrrolidin-1-yl]-2-oxidanylidene-ethanoate

Systemtic Name: 2-[3-(1-hydroxyethyl)-4-(4-methoxy-3-oxidanyl-phenyl)-3-methyl-pyrrolidin-1-yl]-2-oxidanylidene-ethanoate Openeye Name: 2-[3-(1-hydroxyethyl)-4-(3-hydroxy-4-methoxy-phenyl)-3-methyl-pyrrolidin-1-yl]-2-oxo-acetate CAS Name: 2-[3-(1-hydroxyethyl)-4-(3-hydroxy-4-methoxyphenyl)-3-methyl-1-pyrrolidinyl]-2-oxoacetate IUPAC Name: 2-[3-(1-hydroxyethyl)-4-(3-hydroxy-4-methoxyphenyl)-3-methylpyrrolidin-1-yl]-2-oxoacetate Traditional Name: 2-[3-(1-hydroxyethyl)-4-(3-hydroxy-4-methoxy-phenyl)-3-methyl-pyrrolidino]-2-keto-acetate Formula: C16H20NO6- MolecularWeight: 322.3331

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1(CN(CC1C2=CC(=C(C=C2)OC)O)C(=O)C(=O)[O-])C)O

Isomeric SMILES

CC(C1(CN(CC1C2=CC(=C(C=C2)OC)O)C(=O)C(=O)[O-])C)O

InChI

InChI=1S/C16H21NO6/c1-9(18)16(2)8-17(14(20)15(21)22)7-11(16)10-4-5-13(23-3)12(19)6-10/h4-6,9,11,18-19H,7-8H2,1-3H3,(H,21,22)/p-1