ethyl 4-[[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carbonyl]amino]benzoate CAS Name: 4-[[[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 4-[[(4Z)-4-hydroximino-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carbonyl]amino]benzoic acid ethyl ester Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=C(O2)CC(CC3=NO)(C)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C\3=C(O2)CC(C/C3=N/O)(C)C)C

InChI

InChI=1S/C21H24N2O5/c1-5-27-20(25)13-6-8-14(9-7-13)22-19(24)18-12(2)17-15(23-26)10-21(3,4)11-16(17)28-18/h6-9,26H,5,10-11H2,1-4H3,(H,22,24)/b23-15-