N-(2-adamantyl)-N-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(2-adamantyl)-N-methyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(2-adamantyl)-N-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(2-adamantyl)-N-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(2-adamantyl)-N-methyl-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(2-adamantyl)-1-keto-N-methyl-isochroman-3-carboxamide Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1C2CC3CC(C2)CC1C3)C(=O)C4CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

CN(C1C2CC3CC(C2)CC1C3)C(=O)C4CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C21H25NO3/c1-22(19-15-7-12-6-13(9-15)10-16(19)8-12)20(23)18-11-14-4-2-3-5-17(14)21(24)25-18/h2-5,12-13,15-16,18-19H,6-11H2,1H3