(4Z)-4-[[(2-methyl-3-nitro-phenyl)amino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione

Systemtic Name: (4Z)-4-[[(2-methyl-3-nitro-phenyl)amino]methylidene]-2-pyridin-2-yl-isoquinoline-1,3-dione Openeye Name: (4Z)-4-[(2-methyl-3-nitro-anilino)methylene]-2-(2-pyridyl)isoquinoline-1,3-dione CAS Name: (4Z)-4-[(2-methyl-3-nitroanilino)methylidene]-2-(2-pyridinyl)isoquinoline-1,3-dione IUPAC Name: (4Z)-4-[(2-methyl-3-nitroanilino)methylidene]-2-pyridin-2-ylisoquinoline-1,3-dione Traditional Name: (4Z)-4-[(2-methyl-3-nitro-anilino)methylene]-2-(2-pyridyl)isoquinoline-1,3-quinone Formula: C22H16N4O4 MolecularWeight: 400.38684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])N/C=C\2/C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C22H16N4O4/c1-14-18(9-6-10-19(14)26(29)30)24-13-17-15-7-2-3-8-16(15)21(27)25(22(17)28)20-11-4-5-12-23-20/h2-13,24H,1H3/b17-13-