methyl 2-(2-chloroethylcarbamoylamino)-3-methyl-benzoate

Systemtic Name: methyl 2-(2-chloroethylcarbamoylamino)-3-methyl-benzoate Openeye Name: methyl 2-(2-chloroethylcarbamoylamino)-3-methyl-benzoate CAS Name: 2-[[(2-chloroethylamino)-oxomethyl]amino]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 2-(2-chloroethylcarbamoylamino)-3-methylbenzoate Traditional Name: 2-(2-chloroethylcarbamoylamino)-3-methyl-benzoic acid methyl ester Formula: C12H15ClN2O3 MolecularWeight: 270.7121

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)NCCCl)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)NCCCl)C(=O)OC

InChI

InChI=1S/C12H15ClN2O3/c1-8-4-3-5-9(11(16)18-2)10(8)15-12(17)14-7-6-13/h3-5H,6-7H2,1-2H3,(H2,14,15,17)