ethyl 7,7-bis(4-fluorophenyl)-5-oxidanyl-3-oxidanylidene-6-(2-propan-2-yl-1,2,3,4-tetrazol-5-yl)hept-6-enoate

Systemtic Name: ethyl 7,7-bis(4-fluorophenyl)-5-oxidanyl-3-oxidanylidene-6-(2-propan-2-yl-1,2,3,4-tetrazol-5-yl)hept-6-enoate Openeye Name: ethyl 7,7-bis(4-fluorophenyl)-5-hydroxy-6-(2-isopropyltetrazol-5-yl)-3-oxo-hept-6-enoate CAS Name: 7,7-bis(4-fluorophenyl)-5-hydroxy-3-oxo-6-(2-propan-2-yl-5-tetrazolyl)-6-heptenoic acid ethyl ester IUPAC Name: ethyl 7,7-bis(4-fluorophenyl)-5-hydroxy-3-oxo-6-(2-propan-2-yltetrazol-5-yl)hept-6-enoate Traditional Name: 7,7-bis(4-fluorophenyl)-5-hydroxy-6-(2-isopropyltetrazol-5-yl)-3-keto-hept-6-enoic acid ethyl ester Formula: C25H26F2N4O4 MolecularWeight: 484.495146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CC(C(=C(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)C3=NN(N=N3)C(C)C)O

Isomeric SMILES

CCOC(=O)CC(=O)CC(C(=C(C1=CC=C(C=C1)F)C2=CC=C(C=C2)F)C3=NN(N=N3)C(C)C)O

InChI

InChI=1S/C25H26F2N4O4/c1-4-35-22(34)14-20(32)13-21(33)24(25-28-30-31(29-25)15(2)3)23(16-5-9-18(26)10-6-16)17-7-11-19(27)12-8-17/h5-12,15,21,33H,4,13-14H2,1-3H3