4-[[(4-chloranyl-3-nitro-phenyl)amino]methylidene]-2-(2,4-dimethylphenyl)isoquinoline-1,3-dione

Systemtic Name: 4-[[(4-chloranyl-3-nitro-phenyl)amino]methylidene]-2-(2,4-dimethylphenyl)isoquinoline-1,3-dione Openeye Name: 4-[(4-chloro-3-nitro-anilino)methylene]-2-(2,4-dimethylphenyl)isoquinoline-1,3-dione CAS Name: 4-[(4-chloro-3-nitroanilino)methylidene]-2-(2,4-dimethylphenyl)isoquinoline-1,3-dione IUPAC Name: 4-[(4-chloro-3-nitroanilino)methylidene]-2-(2,4-dimethylphenyl)isoquinoline-1,3-dione Traditional Name: 4-[(4-chloro-3-nitro-anilino)methylene]-2-(2,4-dimethylphenyl)isoquinoline-1,3-quinone Formula: C24H18ClN3O4 MolecularWeight: 447.87042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC(=C(C=C4)Cl)[N+](=O)[O-])C2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3C(=CNC4=CC(=C(C=C4)Cl)[N+](=O)[O-])C2=O)C

InChI

InChI=1S/C24H18ClN3O4/c1-14-7-10-21(15(2)11-14)27-23(29)18-6-4-3-5-17(18)19(24(27)30)13-26-16-8-9-20(25)22(12-16)28(31)32/h3-13,26H,1-2H3