N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-methyl-benzamide

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-4-methyl-benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-methyl-benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-4-methylbenzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-4-methylbenzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-4-methyl-benzamide Formula: C18H18ClN3O2 MolecularWeight: 343.80742

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H18ClN3O2/c1-12-2-4-13(5-3-12)18(24)21-14-6-7-16(15(19)10-14)22-9-8-20-17(23)11-22/h2-7,10H,8-9,11H2,1H3,(H,20,23)(H,21,24)