1,2,3,4-tetrahydronaphthalen-1-yl 3,5-dinitrobenzoate

Systemtic Name: 1,2,3,4-tetrahydronaphthalen-1-yl 3,5-dinitrobenzoate Openeye Name: tetralin-1-yl 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 1,2,3,4-tetrahydronaphthalen-1-yl ester IUPAC Name: 1,2,3,4-tetrahydronaphthalen-1-yl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid tetralin-1-yl ester Formula: C17H14N2O6 MolecularWeight: 342.30286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O6/c20-17(12-8-13(18(21)22)10-14(9-12)19(23)24)25-16-7-3-5-11-4-1-2-6-15(11)16/h1-2,4,6,8-10,16H,3,5,7H2