2-(2-chlorophenyl)-6,7-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one

Systemtic Name: 2-(2-chlorophenyl)-6,7-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one Openeye Name: 2-(2-chlorophenyl)-6,7-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one CAS Name: 2-(2-chlorophenyl)-6,7-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]-1-benzopyran-4-one IUPAC Name: 2-(2-chlorophenyl)-6,7-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromen-4-one Traditional Name: 2-(2-chlorophenyl)-6,7-dimethyl-3-[(6-nitro-4H-1,3-benzodioxin-8-yl)methoxy]chromone Formula: C26H20ClNO7 MolecularWeight: 493.8925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CC=C3Cl)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=CC=C3Cl)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5)C

InChI

InChI=1S/C26H20ClNO7/c1-14-7-20-22(8-15(14)2)35-25(19-5-3-4-6-21(19)27)26(23(20)29)33-12-17-10-18(28(30)31)9-16-11-32-13-34-24(16)17/h3-10H,11-13H2,1-2H3