methyl 2-[[3,4-bis(oxidanyl)pyrrolidin-1-yl]carbonylamino]-3-(4-methoxyphenyl)propanoate

Systemtic Name: methyl 2-[[3,4-bis(oxidanyl)pyrrolidin-1-yl]carbonylamino]-3-(4-methoxyphenyl)propanoate Openeye Name: methyl 2-[(3,4-dihydroxypyrrolidine-1-carbonyl)amino]-3-(4-methoxyphenyl)propanoate CAS Name: 2-[[(3,4-dihydroxy-1-pyrrolidinyl)-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-[(3,4-dihydroxypyrrolidine-1-carbonyl)amino]-3-(4-methoxyphenyl)propanoate Traditional Name: 2-[(3,4-dihydroxypyrrolidine-1-carbonyl)amino]-3-(4-methoxyphenyl)propionic acid methyl ester Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)N2CC(C(C2)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC(C(=O)OC)NC(=O)N2CC(C(C2)O)O

InChI

InChI=1S/C16H22N2O6/c1-23-11-5-3-10(4-6-11)7-12(15(21)24-2)17-16(22)18-8-13(19)14(20)9-18/h3-6,12-14,19-20H,7-9H2,1-2H3,(H,17,22)