dimethyl 5-(4-chloranylbutanoylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(4-chloranylbutanoylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(4-chlorobutanoylamino)benzene-1,3-dicarboxylate CAS Name: 5-[(4-chloro-1-oxobutyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4-chlorobutanoylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(4-chlorobutanoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C14H16ClNO5 MolecularWeight: 313.73354

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCCl)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCCl)C(=O)OC

InChI

InChI=1S/C14H16ClNO5/c1-20-13(18)9-6-10(14(19)21-2)8-11(7-9)16-12(17)4-3-5-15/h6-8H,3-5H2,1-2H3,(H,16,17)