methyl 3-azanyl-4-[2,2-bis(acetyloxymethyl)-5-oxidanylidene-pyrrolidin-1-yl]benzoate

Systemtic Name: methyl 3-azanyl-4-[2,2-bis(acetyloxymethyl)-5-oxidanylidene-pyrrolidin-1-yl]benzoate Openeye Name: methyl 3-amino-4-[2,2-bis(acetoxymethyl)-5-oxo-pyrrolidin-1-yl]benzoate CAS Name: 3-amino-4-[2,2-bis(acetyloxymethyl)-5-oxo-1-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 3-amino-4-[2,2-bis(acetyloxymethyl)-5-oxopyrrolidin-1-yl]benzoate Traditional Name: 3-amino-4-[2,2-bis(acetoxymethyl)-5-keto-pyrrolidino]benzoic acid methyl ester Formula: C18H22N2O7 MolecularWeight: 378.37648

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(CCC(=O)N1C2=C(C=C(C=C2)C(=O)OC)N)COC(=O)C

Isomeric SMILES

CC(=O)OCC1(CCC(=O)N1C2=C(C=C(C=C2)C(=O)OC)N)COC(=O)C

InChI

InChI=1S/C18H22N2O7/c1-11(21)26-9-18(10-27-12(2)22)7-6-16(23)20(18)15-5-4-13(8-14(15)19)17(24)25-3/h4-5,8H,6-7,9-10,19H2,1-3H3