(phenylmethyl) (2S,4R)-1-[2-chloroethyl(nitroso)carbamoyl]-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (phenylmethyl) (2S,4R)-1-[2-chloroethyl(nitroso)carbamoyl]-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: benzyl (2S,4R)-1-[2-chloroethyl(nitroso)carbamoyl]-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-[[2-chloroethyl(nitroso)amino]-oxomethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,4R)-1-[2-chloroethyl(nitroso)carbamoyl]-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-[2-chloroethyl(nitroso)carbamoyl]-4-hydroxy-pyrrolidine-2-carboxylic acid benzyl ester Formula: C15H18ClN3O5 MolecularWeight: 355.77352

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)OCC2=CC=CC=C2)C(=O)N(CCCl)N=O)O

Isomeric SMILES

C1[C@H](CN([C@@H]1C(=O)OCC2=CC=CC=C2)C(=O)N(CCCl)N=O)O

InChI

InChI=1S/C15H18ClN3O5/c16-6-7-19(17-23)15(22)18-9-12(20)8-13(18)14(21)24-10-11-4-2-1-3-5-11/h1-5,12-13,20H,6-10H2/t12-,13+/m1/s1