N-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[4-(9H-xanthen-9-ylcarbonyl)piperazin-1-yl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[4-[oxo(9H-xanthen-9-yl)methyl]-1-piperazinyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[4-(9H-xanthene-9-carbonyl)piperazin-1-yl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[4-(9H-xanthene-9-carbonyl)piperazino]phenyl]cyclopropanecarboxamide Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4C5=CC=CC=C5OC6=CC=CC=C46

InChI

InChI=1S/C28H27N3O3/c32-27(19-9-10-19)29-20-11-13-21(14-12-20)30-15-17-31(18-16-30)28(33)26-22-5-1-3-7-24(22)34-25-8-4-2-6-23(25)26/h1-8,11-14,19,26H,9-10,15-18H2,(H,29,32)