N-[2-azanyl-4,6-bis(chloranyl)phenyl]-3-(3-oxidanylidenepiperazin-1-yl)propanamide

Systemtic Name: N-[2-azanyl-4,6-bis(chloranyl)phenyl]-3-(3-oxidanylidenepiperazin-1-yl)propanamide Openeye Name: N-(2-amino-4,6-dichloro-phenyl)-3-(3-oxopiperazin-1-yl)propanamide CAS Name: N-(2-amino-4,6-dichlorophenyl)-3-(3-oxo-1-piperazinyl)propanamide IUPAC Name: N-(2-amino-4,6-dichlorophenyl)-3-(3-oxopiperazin-1-yl)propanamide Traditional Name: N-(2-amino-4,6-dichloro-phenyl)-3-(3-ketopiperazino)propionamide Formula: C13H16Cl2N4O2 MolecularWeight: 331.19774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)CCC(=O)NC2=C(C=C(C=C2N)Cl)Cl

Isomeric SMILES

C1CN(CC(=O)N1)CCC(=O)NC2=C(C=C(C=C2N)Cl)Cl

InChI

InChI=1S/C13H16Cl2N4O2/c14-8-5-9(15)13(10(16)6-8)18-11(20)1-3-19-4-2-17-12(21)7-19/h5-6H,1-4,7,16H2,(H,17,21)(H,18,20)