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

Systemtic Name: N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-fluoranyl-4-methyl-benzamide Openeye Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-fluoro-4-methyl-benzamide CAS Name: N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-3-fluoro-4-methylbenzamide IUPAC Name: N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-fluoro-4-methylbenzamide Traditional Name: N-[3-chloro-4-(3-ketopiperazino)phenyl]-3-fluoro-4-methyl-benzamide Formula: C18H17ClFN3O2 MolecularWeight: 361.797883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClFN3O2/c1-11-2-3-12(8-15(11)20)18(25)22-13-4-5-16(14(19)9-13)23-7-6-21-17(24)10-23/h2-5,8-9H,6-7,10H2,1H3,(H,21,24)(H,22,25)