(4S)-4-(tert-butyliminomethyl)-2-(3,4-dimethylphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-4-(tert-butyliminomethyl)-2-(3,4-dimethylphenyl)-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-(tert-butyliminomethyl)-2-(3,4-dimethylphenyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-(tert-butyliminomethyl)-2-(3,4-dimethylphenyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-(tert-butyliminomethyl)-2-(3,4-dimethylphenyl)-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-(tert-butyliminomethyl)-2-(3,4-dimethylphenyl)-4H-isoquinoline-1,3-quinone Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NC(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)[C@@H](C3=CC=CC=C3C2=O)C=NC(C)(C)C)C

InChI

InChI=1S/C22H24N2O2/c1-14-10-11-16(12-15(14)2)24-20(25)18-9-7-6-8-17(18)19(21(24)26)13-23-22(3,4)5/h6-13,19H,1-5H3/t19-/m1/s1