ethyl 4-[(2-methyl-3-oxidanylidene-4-oxaspiro[4.6]undec-1-en-1-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(2-methyl-3-oxidanylidene-4-oxaspiro[4.6]undec-1-en-1-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(2-methyl-3-oxo-4-oxaspiro[4.6]undec-1-ene-1-carbonyl)amino]benzoate CAS Name: 4-[[(2-methyl-3-oxo-4-oxaspiro[4.6]undec-1-en-1-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2-methyl-3-oxo-4-oxaspiro[4.6]undec-1-ene-1-carbonyl)amino]benzoate Traditional Name: 4-[(3-keto-2-methyl-4-oxaspiro[4.6]undec-1-ene-1-carbonyl)amino]benzoic acid ethyl ester Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=O)OC23CCCCCC3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=O)OC23CCCCCC3)C

InChI

InChI=1S/C21H25NO5/c1-3-26-20(25)15-8-10-16(11-9-15)22-18(23)17-14(2)19(24)27-21(17)12-6-4-5-7-13-21/h8-11H,3-7,12-13H2,1-2H3,(H,22,23)