4-(cycloheptylamino)-2-fluoranyl-1-phenyl-4-(4-phenylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(cycloheptylamino)-2-fluoranyl-1-phenyl-4-(4-phenylpiperazin-1-yl)butan-1-one Openeye Name: 4-(cycloheptylamino)-2-fluoro-1-phenyl-4-(4-phenylpiperazin-1-yl)butan-1-one CAS Name: 4-(cycloheptylamino)-2-fluoro-1-phenyl-4-(4-phenyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(cycloheptylamino)-2-fluoro-1-phenyl-4-(4-phenylpiperazin-1-yl)butan-1-one Traditional Name: 4-(cycloheptylamino)-2-fluoro-1-phenyl-4-(4-phenylpiperazino)butan-1-one Formula: C27H36FN3O MolecularWeight: 437.592643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(CC(C(=O)C2=CC=CC=C2)F)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(CC(C(=O)C2=CC=CC=C2)F)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H36FN3O/c28-25(27(32)22-11-5-3-6-12-22)21-26(29-23-13-7-1-2-8-14-23)31-19-17-30(18-20-31)24-15-9-4-10-16-24/h3-6,9-12,15-16,23,25-26,29H,1-2,7-8,13-14,17-21H2