2-(4-methylidenecyclohex-2-en-1-yl)propan-2-yl 3,5-dinitrobenzoate

Systemtic Name: 2-(4-methylidenecyclohex-2-en-1-yl)propan-2-yl 3,5-dinitrobenzoate Openeye Name: [1-methyl-1-(4-methylenecyclohex-2-en-1-yl)ethyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid 2-(4-methylene-1-cyclohex-2-enyl)propan-2-yl ester IUPAC Name: 2-(4-methylidenecyclohex-2-en-1-yl)propan-2-yl 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [1-methyl-1-(4-methylenecyclohex-2-en-1-yl)ethyl] ester Formula: C17H18N2O6 MolecularWeight: 346.33462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CCC(=C)C=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1CCC(=C)C=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O6/c1-11-4-6-13(7-5-11)17(2,3)25-16(20)12-8-14(18(21)22)10-15(9-12)19(23)24/h4,6,8-10,13H,1,5,7H2,2-3H3