ethyl 4-chloranyl-3-(3-methylbutanoylamino)benzoate

Systemtic Name: ethyl 4-chloranyl-3-(3-methylbutanoylamino)benzoate Openeye Name: ethyl 4-chloro-3-(3-methylbutanoylamino)benzoate CAS Name: 4-chloro-3-[(3-methyl-1-oxobutyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-chloro-3-(3-methylbutanoylamino)benzoate Traditional Name: 4-chloro-3-(isovalerylamino)benzoic acid ethyl ester Formula: C14H18ClNO3 MolecularWeight: 283.75062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC(C)C

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CC(C)C

InChI

InChI=1S/C14H18ClNO3/c1-4-19-14(18)10-5-6-11(15)12(8-10)16-13(17)7-9(2)3/h5-6,8-9H,4,7H2,1-3H3,(H,16,17)