ethyl (1S,3R)-3-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: ethyl (1S,3R)-3-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexane-1-carboxylate Openeye Name: ethyl (1S,3R)-3-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexanecarboxylate CAS Name: (1S,3R)-3-[[[2-chloroethyl(nitroso)amino]-oxomethyl]amino]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1S,3R)-3-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexane-1-carboxylate Traditional Name: (1S,3R)-3-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexanecarboxylic acid ethyl ester Formula: C12H20ClN3O4 MolecularWeight: 305.7579

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC(C1)NC(=O)N(CCCl)N=O

Isomeric SMILES

CCOC(=O)[C@H]1CCC[C@H](C1)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C12H20ClN3O4/c1-2-20-11(17)9-4-3-5-10(8-9)14-12(18)16(15-19)7-6-13/h9-10H,2-8H2,1H3,(H,14,18)/t9-,10+/m0/s1