N-(1-adamantyl)-1-oxidanylidene-isochromene-3-carboxamide

Systemtic Name: N-(1-adamantyl)-1-oxidanylidene-isochromene-3-carboxamide Openeye Name: N-(1-adamantyl)-1-oxo-isochromene-3-carboxamide CAS Name: N-(1-adamantyl)-1-oxo-2-benzopyran-3-carboxamide IUPAC Name: N-(1-adamantyl)-1-oxoisochromene-3-carboxamide Traditional Name: N-(1-adamantyl)-1-keto-isochromene-3-carboxamide Formula: C20H21NO3 MolecularWeight: 323.38564

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C20H21NO3/c22-18(17-8-15-3-1-2-4-16(15)19(23)24-17)21-20-9-12-5-13(10-20)7-14(6-12)11-20/h1-4,8,12-14H,5-7,9-11H2,(H,21,22)