4-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-yl-cubane-1-carboxamide

Systemtic Name: 4-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-yl-cubane-1-carboxamide Openeye Name: 4-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-(2-pyridyl)cubane-1-carboxamide CAS Name: 4-iodanyl-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-N-(2-pyridinyl)-1-cubanecarboxamide IUPAC Name: 4-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-ylcubane-1-carboxamide Traditional Name: 4-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazino]ethyl]-N-(2-pyridyl)cubane-1-carboxamide Formula: C27H29IN4O2 MolecularWeight: 564.450358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C45C6C7C4C8C5C6C78I

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=N3)C(=O)C45C6C7C4C8C5C6C78[123I]

InChI

InChI=1S/C27H29IN4O2/c1-34-17-7-3-2-6-16(17)31-13-10-30(11-14-31)12-15-32(18-8-4-5-9-29-18)25(33)26-19-22-20(26)24-21(26)23(19)27(22,24)28/h2-9,19-24H,10-15H2,1H3/i28-4