(phenylmethyl) 2-[[1-methoxy-3-(4-nitro-1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[[1-methoxy-3-(4-nitro-1H-imidazol-5-yl)-1-oxidanylidene-propan-2-yl]carbamoyl]-5-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: benzyl 2-[[2-methoxy-1-[(4-nitro-1H-imidazol-5-yl)methyl]-2-oxo-ethyl]carbamoyl]-5-oxo-pyrrolidine-1-carboxylate CAS Name: 2-[[[1-methoxy-3-(4-nitro-1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-oxomethyl]-5-oxo-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-methoxy-3-(4-nitro-1H-imidazol-5-yl)-1-oxopropan-2-yl]carbamoyl]-5-oxopyrrolidine-1-carboxylate Traditional Name: 2-keto-5-[[2-keto-2-methoxy-1-[(4-nitro-1H-imidazol-5-yl)methyl]ethyl]carbamoyl]pyrrolidine-1-carboxylic acid benzyl ester Formula: C20H21N5O8 MolecularWeight: 459.40944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=C(N=CN1)[N+](=O)[O-])NC(=O)C2CCC(=O)N2C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C(CC1=C(N=CN1)[N+](=O)[O-])NC(=O)C2CCC(=O)N2C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O8/c1-32-19(28)14(9-13-17(25(30)31)22-11-21-13)23-18(27)15-7-8-16(26)24(15)20(29)33-10-12-5-3-2-4-6-12/h2-6,11,14-15H,7-10H2,1H3,(H,21,22)(H,23,27)