N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2,4-dimethyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-2,4-dimethyl-benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2,4-dimethyl-benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-2,4-dimethylbenzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-2,4-dimethylbenzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-2,4-dimethyl-benzamide Formula: C19H20ClN3O2 MolecularWeight: 357.834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCNC(=O)C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCNC(=O)C3)Cl)C

InChI

InChI=1S/C19H20ClN3O2/c1-12-3-5-15(13(2)9-12)19(25)22-14-4-6-17(16(20)10-14)23-8-7-21-18(24)11-23/h3-6,9-10H,7-8,11H2,1-2H3,(H,21,24)(H,22,25)