(1S,2S)-N-[2-(3-ethanoylphenyl)-3H-isoindol-1-ylidene]-2-methyl-cyclopropane-1-carboxamide

Systemtic Name: (1S,2S)-N-[2-(3-ethanoylphenyl)-3H-isoindol-1-ylidene]-2-methyl-cyclopropane-1-carboxamide Openeye Name: (1S,2S)-N-[2-(3-acetylphenyl)isoindolin-1-ylidene]-2-methyl-cyclopropanecarboxamide CAS Name: (1S,2S)-N-[2-(3-acetylphenyl)-3H-isoindol-1-ylidene]-2-methyl-1-cyclopropanecarboxamide IUPAC Name: (1S,2S)-N-[2-(3-acetylphenyl)-3H-isoindol-1-ylidene]-2-methylcyclopropane-1-carboxamide Traditional Name: (1S,2S)-N-[2-(3-acetylphenyl)isoindolin-1-ylidene]-2-methyl-cyclopropanecarboxamide Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)N=C2C3=CC=CC=C3CN2C4=CC=CC(=C4)C(=O)C

Isomeric SMILES

C[C@H]1C[C@@H]1C(=O)N=C2C3=CC=CC=C3CN2C4=CC=CC(=C4)C(=O)C

InChI

InChI=1S/C21H20N2O2/c1-13-10-19(13)21(25)22-20-18-9-4-3-6-16(18)12-23(20)17-8-5-7-15(11-17)14(2)24/h3-9,11,13,19H,10,12H2,1-2H3/t13-,19-/m0/s1