N-(4-iodanyl-2-methyl-phenyl)-6-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(4-iodanyl-2-methyl-phenyl)-6-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(4-iodo-2-methyl-phenyl)-6-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(4-iodo-2-methylphenyl)-6-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(4-iodo-2-methylphenyl)-6-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(4-iodo-2-methyl-phenyl)-1-keto-6-methyl-isochroman-3-carboxamide Formula: C18H16INO3 MolecularWeight: 421.22901

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=C(C=C(C=C3)I)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=C(C=C(C=C3)I)C

InChI

InChI=1S/C18H16INO3/c1-10-3-5-14-12(7-10)9-16(23-18(14)22)17(21)20-15-6-4-13(19)8-11(15)2/h3-8,16H,9H2,1-2H3,(H,20,21)