(10-methylspiro[4.5]dec-9-en-6-yl) 3,5-dinitrobenzoate

Systemtic Name: (10-methylspiro[4.5]dec-9-en-6-yl) 3,5-dinitrobenzoate Openeye Name: (10-methylspiro[4.5]dec-9-en-6-yl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (10-methyl-6-spiro[4.5]dec-9-enyl) ester IUPAC Name: (10-methylspiro[4.5]dec-9-en-6-yl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (10-methylspiro[4.5]dec-9-en-6-yl) ester Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCCC(C12CCCC2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CCCC(C12CCCC2)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O6/c1-12-5-4-6-16(18(12)7-2-3-8-18)26-17(21)13-9-14(19(22)23)11-15(10-13)20(24)25/h5,9-11,16H,2-4,6-8H2,1H3