N-(3-ethynylphenyl)-3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(3-ethynylphenyl)-3-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-(3-ethynylphenyl)-3-(5-methyl-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(3-ethynylphenyl)-3-(5-methyl-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(3-ethynylphenyl)-3-(5-methyl-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: 3-(1,3-diketo-5-methyl-isoindolin-2-yl)-N-(3-ethynylphenyl)propionamide Formula: C20H16N2O3 MolecularWeight: 332.35264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCC(=O)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C20H16N2O3/c1-3-14-5-4-6-15(12-14)21-18(23)9-10-22-19(24)16-8-7-13(2)11-17(16)20(22)25/h1,4-8,11-12H,9-10H2,2H3,(H,21,23)