(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanoate

Systemtic Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanoate Openeye Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-tetralin-6-ylacetate CAS Name: 2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester IUPAC Name: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetate Traditional Name: 2-tetralin-6-ylacetic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester Formula: C21H21NO6 MolecularWeight: 383.39454

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)CC(=O)OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)CC(=O)OCC3=C4C(=CC(=C3)[N+](=O)[O-])COCO4

InChI

InChI=1S/C21H21NO6/c23-20(8-14-5-6-15-3-1-2-4-16(15)7-14)27-12-18-10-19(22(24)25)9-17-11-26-13-28-21(17)18/h5-7,9-10H,1-4,8,11-13H2