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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1Cl)N)Cl)N2CCNC(=O)C2

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1Cl)N)Cl)N2CCNC(=O)C2

InChI

InChI=1S/C13H16Cl2N4O2/c1-7(19-3-2-17-11(20)6-19)13(21)18-12-9(14)4-8(16)5-10(12)15/h4-5,7H,2-3,6,16H2,1H3,(H,17,20)(H,18,21)