1-[4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]piperazin-1-yl]xanthen-9-one

Systemtic Name: 1-[4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]piperazin-1-yl]xanthen-9-one Openeye Name: 1-[4-[2-(4-isobutylpiperazin-1-yl)ethyl]piperazin-1-yl]xanthen-9-one CAS Name: 1-[4-[2-[4-(2-methylpropyl)-1-piperazinyl]ethyl]-1-piperazinyl]-9-xanthenone IUPAC Name: 1-[4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]piperazin-1-yl]xanthen-9-one Traditional Name: 1-[4-[2-(4-isobutylpiperazino)ethyl]piperazino]xanthone Formula: C27H36N4O2 MolecularWeight: 448.60034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)CCN2CCN(CC2)C3=C4C(=CC=C3)OC5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)CN1CCN(CC1)CCN2CCN(CC2)C3=C4C(=CC=C3)OC5=CC=CC=C5C4=O

InChI

InChI=1S/C27H36N4O2/c1-21(2)20-30-14-12-28(13-15-30)10-11-29-16-18-31(19-17-29)23-7-5-9-25-26(23)27(32)22-6-3-4-8-24(22)33-25/h3-9,21H,10-20H2,1-2H3