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

Systemtic Name: 3-chloranyl-4-fluoranyl-N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]benzamide Openeye Name: 3-chloro-4-fluoro-N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]benzamide CAS Name: 3-chloro-4-fluoro-N-[3-[4-methyl-1-(4-phenyl-1-piperazinyl)cyclohexyl]phenyl]benzamide IUPAC Name: 3-chloro-4-fluoro-N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]benzamide Traditional Name: 3-chloro-4-fluoro-N-[3-[4-methyl-1-(4-phenylpiperazino)cyclohexyl]phenyl]benzamide Formula: C30H33ClFN3O MolecularWeight: 506.053923

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)F)Cl)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)F)Cl)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H33ClFN3O/c1-22-12-14-30(15-13-22,35-18-16-34(17-19-35)26-8-3-2-4-9-26)24-6-5-7-25(21-24)33-29(36)23-10-11-28(32)27(31)20-23/h2-11,20-22H,12-19H2,1H3,(H,33,36)