N-[1-(1-adamantyl)propyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-1-keto-isochroman-3-carboxamide Formula: C23H29NO3 MolecularWeight: 367.48126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C23H29NO3/c1-2-20(23-11-14-7-15(12-23)9-16(8-14)13-23)24-21(25)19-10-17-5-3-4-6-18(17)22(26)27-19/h3-6,14-16,19-20H,2,7-13H2,1H3,(H,24,25)