3-cyanopropyl 2-[(3,4-dichlorophenyl)carbonylamino]ethanoate

Systemtic Name: 3-cyanopropyl 2-[(3,4-dichlorophenyl)carbonylamino]ethanoate Openeye Name: 3-cyanopropyl 2-[(3,4-dichlorobenzoyl)amino]acetate CAS Name: 2-[[(3,4-dichlorophenyl)-oxomethyl]amino]acetic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 2-[(3,4-dichlorobenzoyl)amino]acetate Traditional Name: 2-[(3,4-dichlorobenzoyl)amino]acetic acid 3-cyanopropyl ester Formula: C13H12Cl2N2O3 MolecularWeight: 315.15198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCC(=O)OCCCC#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCC(=O)OCCCC#N)Cl)Cl

InChI

InChI=1S/C13H12Cl2N2O3/c14-10-4-3-9(7-11(10)15)13(19)17-8-12(18)20-6-2-1-5-16/h3-4,7H,1-2,6,8H2,(H,17,19)