(4E)-4-[[4-(methylamino)-3-nitro-phenyl]methylidene]isoquinoline-1,3-dione

Systemtic Name: (4E)-4-[[4-(methylamino)-3-nitro-phenyl]methylidene]isoquinoline-1,3-dione Openeye Name: (4E)-4-[[4-(methylamino)-3-nitro-phenyl]methylene]isoquinoline-1,3-dione CAS Name: (4E)-4-[[4-(methylamino)-3-nitrophenyl]methylidene]isoquinoline-1,3-dione IUPAC Name: (4E)-4-[[4-(methylamino)-3-nitrophenyl]methylidene]isoquinoline-1,3-dione Traditional Name: (4E)-4-[4-(methylamino)-3-nitro-benzylidene]isoquinoline-1,3-quinone Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C=C2C3=CC=CC=C3C(=O)NC2=O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)/C=C/2\C3=CC=CC=C3C(=O)NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O4/c1-18-14-7-6-10(9-15(14)20(23)24)8-13-11-4-2-3-5-12(11)16(21)19-17(13)22/h2-9,18H,1H3,(H,19,21,22)/b13-8+