(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]naphthalene-2-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]naphthalene-2-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-[(3,5-dimethylisoxazol-4-yl)methoxy]naphthalene-2-carboxylate CAS Name: 3-[(3,5-dimethyl-4-isoxazolyl)methoxy]-2-naphthalenecarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]naphthalene-2-carboxylate Traditional Name: 3-[(3,5-dimethylisoxazol-4-yl)methoxy]naphthalene-2-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C26H22N2O8 MolecularWeight: 490.46148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=CC3=CC=CC=C3C=C2C(=O)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=CC3=CC=CC=C3C=C2C(=O)OCC4=C5C(=CC(=C4)[N+](=O)[O-])COCO5

InChI

InChI=1S/C26H22N2O8/c1-15-23(16(2)36-27-15)13-33-24-10-18-6-4-3-5-17(18)9-22(24)26(29)34-12-20-8-21(28(30)31)7-19-11-32-14-35-25(19)20/h3-10H,11-14H2,1-2H3