(3S)-3-[(3,4-dimethylphenyl)amino]-3H-2-benzofuran-1-one

Systemtic Name: (3S)-3-[(3,4-dimethylphenyl)amino]-3H-2-benzofuran-1-one Openeye Name: (3S)-3-(3,4-dimethylanilino)-3H-isobenzofuran-1-one CAS Name: (3S)-3-(3,4-dimethylanilino)-3H-isobenzofuran-1-one IUPAC Name: (3S)-3-(3,4-dimethylanilino)-3H-2-benzofuran-1-one Traditional Name: (3S)-3-(3,4-dimethylanilino)phthalide Formula: C16H15NO2 MolecularWeight: 253.2958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2C3=CC=CC=C3C(=O)O2)C

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@@H]2C3=CC=CC=C3C(=O)O2)C

InChI

InChI=1S/C16H15NO2/c1-10-7-8-12(9-11(10)2)17-15-13-5-3-4-6-14(13)16(18)19-15/h3-9,15,17H,1-2H3/t15-/m0/s1