N-(4-ethoxyphenyl)-6-ethyl-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-(4-ethoxyphenyl)-6-ethyl-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: N-(4-ethoxyphenyl)-6-ethyl-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(4-ethoxyphenyl)-6-ethyl-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(4-ethoxyphenyl)-6-ethyl-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 6-ethyl-1-keto-3-methyl-N-p-phenetyl-isochroman-3-carboxamide Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=C(C=C3)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H23NO4/c1-4-14-6-11-18-15(12-14)13-21(3,26-19(18)23)20(24)22-16-7-9-17(10-8-16)25-5-2/h6-12H,4-5,13H2,1-3H3,(H,22,24)