7-bromanyl-N9-[1-(cyclooctylmethyl)piperidin-4-yl]-9H-xanthene-2,9-dicarboxamide

Systemtic Name: 7-bromanyl-N9-[1-(cyclooctylmethyl)piperidin-4-yl]-9H-xanthene-2,9-dicarboxamide Openeye Name: 7-bromo-N9-[1-(cyclooctylmethyl)-4-piperidyl]-9H-xanthene-2,9-dicarboxamide CAS Name: 7-bromo-N9-[1-(cyclooctylmethyl)-4-piperidinyl]-9H-xanthene-2,9-dicarboxamide IUPAC Name: 7-bromo-9-N-[1-(cyclooctylmethyl)piperidin-4-yl]-9H-xanthene-2,9-dicarboxamide Traditional Name: 7-bromo-N'-[1-(cyclooctylmethyl)-4-piperidyl]-9H-xanthene-2,9-dicarboxamide Formula: C29H36BrN3O3 MolecularWeight: 554.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)CN2CCC(CC2)NC(=O)C3C4=C(C=CC(=C4)C(=O)N)OC5=C3C=C(C=C5)Br

Isomeric SMILES

C1CCCC(CCC1)CN2CCC(CC2)NC(=O)C3C4=C(C=CC(=C4)C(=O)N)OC5=C3C=C(C=C5)Br

InChI

InChI=1S/C29H36BrN3O3/c30-21-9-11-26-24(17-21)27(23-16-20(28(31)34)8-10-25(23)36-26)29(35)32-22-12-14-33(15-13-22)18-19-6-4-2-1-3-5-7-19/h8-11,16-17,19,22,27H,1-7,12-15,18H2,(H2,31,34)(H,32,35)