ethyl 4-[(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(5-ethyl-3,3-dimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)amino]-4-oxo-butanoate CAS Name: 4-[(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(5-ethyl-3,3-dimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)amino]-4-oxobutanoate Traditional Name: 4-[(5-ethyl-4-keto-3,3-dimethyl-2H-1,5-benzoxazepin-8-yl)amino]-4-keto-butyric acid ethyl ester Formula: C19H26N2O5 MolecularWeight: 362.42014

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)CCC(=O)OCC)OCC(C1=O)(C)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)CCC(=O)OCC)OCC(C1=O)(C)C

InChI

InChI=1S/C19H26N2O5/c1-5-21-14-8-7-13(20-16(22)9-10-17(23)25-6-2)11-15(14)26-12-19(3,4)18(21)24/h7-8,11H,5-6,9-10,12H2,1-4H3,(H,20,22)