(2S,4R)-1-(3,4-dimethoxyphenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (2S,4R)-1-(3,4-dimethoxyphenyl)carbonyl-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: (2S,4R)-1-(3,4-dimethoxybenzoyl)-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[(3,4-dimethoxyphenyl)-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylate IUPAC Name: (2S,4R)-1-(3,4-dimethoxybenzoyl)-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-hydroxy-1-veratroyl-pyrrolidine-2-carboxylate Formula: C14H16NO6- MolecularWeight: 294.27994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CC(CC2C(=O)[O-])O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C[C@@H](C[C@H]2C(=O)[O-])O)OC

InChI

InChI=1S/C14H17NO6/c1-20-11-4-3-8(5-12(11)21-2)13(17)15-7-9(16)6-10(15)14(18)19/h3-5,9-10,16H,6-7H2,1-2H3,(H,18,19)/p-1/t9-,10+/m1/s1