[4-[2-chloroethylcarbamoyl(nitroso)amino]cyclohexyl] 1-methyl-4H-pyridine-3-carboxylate

Systemtic Name: [4-[2-chloroethylcarbamoyl(nitroso)amino]cyclohexyl] 1-methyl-4H-pyridine-3-carboxylate Openeye Name: [4-[2-chloroethylcarbamoyl(nitroso)amino]cyclohexyl] 1-methyl-4H-pyridine-3-carboxylate CAS Name: 1-methyl-4H-pyridine-3-carboxylic acid [4-[[(2-chloroethylamino)-oxomethyl]-nitrosoamino]cyclohexyl] ester IUPAC Name: [4-[2-chloroethylcarbamoyl(nitroso)amino]cyclohexyl] 1-methyl-4H-pyridine-3-carboxylate Traditional Name: 1-methyl-4H-pyridine-3-carboxylic acid [4-[2-chloroethylcarbamoyl(nitroso)amino]cyclohexyl] ester Formula: C16H23ClN4O4 MolecularWeight: 370.83122

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CCC(=C1)C(=O)OC2CCC(CC2)N(C(=O)NCCCl)N=O

Isomeric SMILES

CN1C=CCC(=C1)C(=O)OC2CCC(CC2)N(C(=O)NCCCl)N=O

InChI

InChI=1S/C16H23ClN4O4/c1-20-10-2-3-12(11-20)15(22)25-14-6-4-13(5-7-14)21(19-24)16(23)18-9-8-17/h2,10-11,13-14H,3-9H2,1H3,(H,18,23)