3-carboxy-7-diethylazaniumylidene-4-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-2-olate

Systemtic Name: 3-carboxy-7-diethylazaniumylidene-4-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-2-olate Openeye Name: 3-carboxy-7-diethyliminio-4-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-2-olate CAS Name: 3-carboxy-7-diethyliminio-4-(trifluoromethyl)-5,6,8,8a-tetrahydro-1-benzopyran-2-olate IUPAC Name: 3-carboxy-7-diethylazaniumylidene-4-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-2-olate Traditional Name: 3-carboxy-7-diethyliminio-4-(trifluoromethyl)-5,6,8,8a-tetrahydrochromen-2-olate Formula: C15H18F3NO4 MolecularWeight: 333.30293

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](=C1CCC2=C(C(=C(OC2C1)[O-])C(=O)O)C(F)(F)F)CC

Isomeric SMILES

CC[N+](=C1CCC2=C(C(=C(OC2C1)[O-])C(=O)O)C(F)(F)F)CC

InChI

InChI=1S/C15H18F3NO4/c1-3-19(4-2)8-5-6-9-10(7-8)23-14(22)11(13(20)21)12(9)15(16,17)18/h10H,3-7H2,1-2H3,(H-,20,21,22)