dimethyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]butanedioate

Systemtic Name: dimethyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]butanedioate Openeye Name: dimethyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]butanedioate CAS Name: (2S)-2-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]butanedioate Traditional Name: (2S)-2-[[2-chloroethyl(nitroso)carbamoyl]amino]succinic acid dimethyl ester Formula: C9H14ClN3O6 MolecularWeight: 295.67696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)OC)NC(=O)N(CCCl)N=O

Isomeric SMILES

COC(=O)C[C@@H](C(=O)OC)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C9H14ClN3O6/c1-18-7(14)5-6(8(15)19-2)11-9(16)13(12-17)4-3-10/h6H,3-5H2,1-2H3,(H,11,16)/t6-/m0/s1