3-(3-iodanyl-1-adamantyl)-2-oxidanyl-benzaldehyde

Systemtic Name: 3-(3-iodanyl-1-adamantyl)-2-oxidanyl-benzaldehyde Openeye Name: 2-hydroxy-3-(3-iodo-1-adamantyl)benzaldehyde CAS Name: 2-hydroxy-3-(3-iodo-1-adamantyl)benzaldehyde IUPAC Name: 2-hydroxy-3-(3-iodo-1-adamantyl)benzaldehyde Traditional Name: 2-hydroxy-3-(3-iodo-1-adamantyl)benzaldehyde Formula: C17H19IO2 MolecularWeight: 382.23603

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)I)C4=CC=CC(=C4O)C=O

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)I)C4=CC=CC(=C4O)C=O

InChI

InChI=1S/C17H19IO2/c18-17-7-11-4-12(8-17)6-16(5-11,10-17)14-3-1-2-13(9-19)15(14)20/h1-3,9,11-12,20H,4-8,10H2