(4Z)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid

Systemtic Name: (4Z)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Openeye Name: (4Z)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid CAS Name: (4Z)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid IUPAC Name: (4Z)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid Traditional Name: (4Z)-4-[(6-nitro-1,3-benzodioxol-5-yl)methylene]-2,3-dihydro-1H-acridine-9-carboxylic acid Formula: C22H16N2O6 MolecularWeight: 404.37224

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C4=NC5=CC=CC=C5C(=C4C1)C(=O)O

Isomeric SMILES

C1C/C(=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)/C4=NC5=CC=CC=C5C(=C4C1)C(=O)O

InChI

InChI=1S/C22H16N2O6/c25-22(26)20-14-5-1-2-7-16(14)23-21-12(4-3-6-15(20)21)8-13-9-18-19(30-11-29-18)10-17(13)24(27)28/h1-2,5,7-10H,3-4,6,11H2,(H,25,26)/b12-8-