(4E)-4-[(3-nitro-4-propan-2-yl-phenyl)methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-4-[(3-nitro-4-propan-2-yl-phenyl)methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-4-[(4-isopropyl-3-nitro-phenyl)methylene]isoquinoline-1,3-dione CAS Name: (4E)-4-[(3-nitro-4-propan-2-ylphenyl)methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-4-[(3-nitro-4-propan-2-ylphenyl)methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-4-(4-isopropyl-3-nitro-benzylidene)isoquinoline-1,3-quinone Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C2C3=CC=CC=C3C(=O)NC2=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C/2\C3=CC=CC=C3C(=O)NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O4/c1-11(2)13-8-7-12(10-17(13)21(24)25)9-16-14-5-3-4-6-15(14)18(22)20-19(16)23/h3-11H,1-2H3,(H,20,22,23)/b16-9+