dimethyl 3-(2-chloranylethanoylamino)cyclohexa-1,5-diene-1,4-dicarboxylate

Systemtic Name: dimethyl 3-(2-chloranylethanoylamino)cyclohexa-1,5-diene-1,4-dicarboxylate Openeye Name: dimethyl 3-[(2-chloroacetyl)amino]cyclohexa-1,5-diene-1,4-dicarboxylate CAS Name: 3-[(2-chloro-1-oxoethyl)amino]cyclohexa-1,5-diene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[(2-chloroacetyl)amino]cyclohexa-1,5-diene-1,4-dicarboxylate Traditional Name: 3-[(2-chloroacetyl)amino]cyclohexa-1,5-diene-1,4-dicarboxylic acid dimethyl ester Formula: C12H14ClNO5 MolecularWeight: 287.69626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C=CC(=CC1NC(=O)CCl)C(=O)OC

Isomeric SMILES

COC(=O)C1C=CC(=CC1NC(=O)CCl)C(=O)OC

InChI

InChI=1S/C12H14ClNO5/c1-18-11(16)7-3-4-8(12(17)19-2)9(5-7)14-10(15)6-13/h3-5,8-9H,6H2,1-2H3,(H,14,15)