N-(4-butan-2-ylphenyl)-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: N-(4-butan-2-ylphenyl)-3-methyl-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 3-methyl-1-oxo-N-(4-sec-butylphenyl)isochromane-3-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(4-butan-2-ylphenyl)-3-methyl-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3-methyl-N-(4-sec-butylphenyl)isochroman-3-carboxamide Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2(CC3=CC=CC=C3C(=O)O2)C

InChI

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