4-fluoranyl-N-[2-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]ethyl]benzamide

Systemtic Name: 4-fluoranyl-N-[2-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]ethyl]benzamide Openeye Name: 4-fluoro-N-[2-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]ethyl]benzamide CAS Name: 4-fluoro-N-[2-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]ethyl]benzamide IUPAC Name: 4-fluoro-N-[2-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]ethyl]benzamide Traditional Name: 4-fluoro-N-[2-[4-(9H-xanthene-9-carbonyl)piperazino]ethyl]benzamide Formula: C27H26FN3O3 MolecularWeight: 459.512043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)F)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC=C(C=C2)F)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C27H26FN3O3/c28-20-11-9-19(10-12-20)26(32)29-13-14-30-15-17-31(18-16-30)27(33)25-21-5-1-3-7-23(21)34-24-8-4-2-6-22(24)25/h1-12,25H,13-18H2,(H,29,32)