(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl (4E)-4-[(3-nitrophenyl)methylene]-2,3-dihydro-1H-acridine-9-carboxylate CAS Name: (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl (4E)-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1H-acridine-9-carboxylate Traditional Name: (4E)-4-(3-nitrobenzylidene)-2,3-dihydro-1H-acridine-9-carboxylic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C33H26N2O6 MolecularWeight: 546.56934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=C4CCCC(=CC5=CC(=CC=C5)[N+](=O)[O-])C4=NC6=CC=CC=C63)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=C4CCC/C(=C\C5=CC(=CC=C5)[N+](=O)[O-])/C4=NC6=CC=CC=C63)C

InChI

InChI=1S/C33H26N2O6/c1-19-13-27-23(17-30(36)41-29(27)14-20(19)2)18-40-33(37)31-25-10-3-4-12-28(25)34-32-22(8-6-11-26(31)32)15-21-7-5-9-24(16-21)35(38)39/h3-5,7,9-10,12-17H,6,8,11,18H2,1-2H3/b22-15+