methyl 1-(2-chloroethylcarbamoylamino)-5-methyl-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: methyl 1-(2-chloroethylcarbamoylamino)-5-methyl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: methyl 1-(2-chloroethylcarbamoylamino)-5-methyl-cyclohexa-2,4-diene-1-carboxylate CAS Name: 1-[[(2-chloroethylamino)-oxomethyl]amino]-5-methyl-1-cyclohexa-2,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-chloroethylcarbamoylamino)-5-methylcyclohexa-2,4-diene-1-carboxylate Traditional Name: 1-(2-chloroethylcarbamoylamino)-5-methyl-cyclohexa-2,4-diene-1-carboxylic acid methyl ester Formula: C12H17ClN2O3 MolecularWeight: 272.72798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1)(C(=O)OC)NC(=O)NCCCl

Isomeric SMILES

CC1=CC=CC(C1)(C(=O)OC)NC(=O)NCCCl

InChI

InChI=1S/C12H17ClN2O3/c1-9-4-3-5-12(8-9,10(16)18-2)15-11(17)14-7-6-13/h3-5H,6-8H2,1-2H3,(H2,14,15,17)