methyl 3-azanyl-4-[2-(2-hydroxyethyl)-2-(hydroxymethyl)-5-oxidanylidene-pyrrolidin-1-yl]benzoate

Systemtic Name: methyl 3-azanyl-4-[2-(2-hydroxyethyl)-2-(hydroxymethyl)-5-oxidanylidene-pyrrolidin-1-yl]benzoate Openeye Name: methyl 3-amino-4-[2-(2-hydroxyethyl)-2-(hydroxymethyl)-5-oxo-pyrrolidin-1-yl]benzoate CAS Name: 3-amino-4-[2-(2-hydroxyethyl)-2-(hydroxymethyl)-5-oxo-1-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-[2-(2-hydroxyethyl)-2-(hydroxymethyl)-5-oxopyrrolidin-1-yl]benzoate Traditional Name: 3-amino-4-[2-(2-hydroxyethyl)-5-keto-2-methylol-pyrrolidino]benzoic acid methyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2C(=O)CCC2(CCO)CO)N

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2C(=O)CCC2(CCO)CO)N

InChI

InChI=1S/C15H20N2O5/c1-22-14(21)10-2-3-12(11(16)8-10)17-13(20)4-5-15(17,9-19)6-7-18/h2-3,8,18-19H,4-7,9,16H2,1H3