2-(2,4-dimethylphenyl)-4-[[(2-methyl-5-nitro-phenyl)amino]methylidene]isoquinoline-1,3-dione

Systemtic Name: 2-(2,4-dimethylphenyl)-4-[[(2-methyl-5-nitro-phenyl)amino]methylidene]isoquinoline-1,3-dione Openeye Name: 2-(2,4-dimethylphenyl)-4-[(2-methyl-5-nitro-anilino)methylene]isoquinoline-1,3-dione CAS Name: 2-(2,4-dimethylphenyl)-4-[(2-methyl-5-nitroanilino)methylidene]isoquinoline-1,3-dione IUPAC Name: 2-(2,4-dimethylphenyl)-4-[(2-methyl-5-nitroanilino)methylidene]isoquinoline-1,3-dione Traditional Name: 2-(2,4-dimethylphenyl)-4-[(2-methyl-5-nitro-anilino)methylene]isoquinoline-1,3-quinone Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21N3O4/c1-15-8-11-23(17(3)12-15)27-24(29)20-7-5-4-6-19(20)21(25(27)30)14-26-22-13-18(28(31)32)10-9-16(22)2/h4-14,26H,1-3H3