N-(6-ethanoyl-8-iodanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-(hydroxymethyl)benzamide

Systemtic Name: N-(6-ethanoyl-8-iodanyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-(hydroxymethyl)benzamide Openeye Name: N-(6-acetyl-3-hydroxy-8-iodo-2,2-dimethyl-chroman-4-yl)-3-(hydroxymethyl)benzamide CAS Name: N-(6-acetyl-3-hydroxy-8-iodo-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-(hydroxymethyl)benzamide IUPAC Name: N-(6-acetyl-3-hydroxy-8-iodo-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-(hydroxymethyl)benzamide Traditional Name: N-(6-acetyl-3-hydroxy-8-iodo-2,2-dimethyl-chroman-4-yl)-3-methylol-benzamide Formula: C21H22INO5 MolecularWeight: 495.30755

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C(=C1)I)OC(C(C2NC(=O)C3=CC(=CC=C3)CO)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C(=C1)I)OC(C(C2NC(=O)C3=CC(=CC=C3)CO)O)(C)C

InChI

InChI=1S/C21H22INO5/c1-11(25)14-8-15-17(19(26)21(2,3)28-18(15)16(22)9-14)23-20(27)13-6-4-5-12(7-13)10-24/h4-9,17,19,24,26H,10H2,1-3H3,(H,23,27)