(6-nitro-4H-1,3-benzodioxin-8-yl)methyl cyclohex-3-ene-1-carboxylate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl cyclohex-3-ene-1-carboxylate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl cyclohex-3-ene-1-carboxylate CAS Name: 1-cyclohex-3-enecarboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl cyclohex-3-ene-1-carboxylate Traditional Name: cyclohex-3-ene-1-carboxylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C16H17NO6 MolecularWeight: 319.30928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

Isomeric SMILES

C1CC(CC=C1)C(=O)OCC2=C3C(=CC(=C2)[N+](=O)[O-])COCO3

InChI

InChI=1S/C16H17NO6/c18-16(11-4-2-1-3-5-11)22-9-13-7-14(17(19)20)6-12-8-21-10-23-15(12)13/h1-2,6-7,11H,3-5,8-10H2