dimethyl 2-(3-chloranylbutanoylamino)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-(3-chloranylbutanoylamino)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-(3-chlorobutanoylamino)benzene-1,4-dicarboxylate CAS Name: 2-[(3-chloro-1-oxobutyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(3-chlorobutanoylamino)benzene-1,4-dicarboxylate Traditional Name: 2-(3-chlorobutanoylamino)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C14H16ClNO5 MolecularWeight: 313.73354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)Cl

Isomeric SMILES

CC(CC(=O)NC1=C(C=CC(=C1)C(=O)OC)C(=O)OC)Cl

InChI

InChI=1S/C14H16ClNO5/c1-8(15)6-12(17)16-11-7-9(13(18)20-2)4-5-10(11)14(19)21-3/h4-5,7-8H,6H2,1-3H3,(H,16,17)