N-(2-ethylphenyl)-1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(2-ethylphenyl)-1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(2-ethylphenyl)-6-isopropyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(2-ethylphenyl)-1-oxo-6-propan-2-yl-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(2-ethylphenyl)-1-oxo-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(2-ethylphenyl)-6-isopropyl-1-keto-isochroman-3-carboxamide Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

InChI

InChI=1S/C21H23NO3/c1-4-14-7-5-6-8-18(14)22-20(23)19-12-16-11-15(13(2)3)9-10-17(16)21(24)25-19/h5-11,13,19H,4,12H2,1-3H3,(H,22,23)