ethyl 4-(6-cyano-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate

Systemtic Name: ethyl 4-(6-cyano-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl)butanoate Openeye Name: ethyl 4-(6-cyano-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)butanoate CAS Name: 4-(6-cyano-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)butanoic acid ethyl ester IUPAC Name: ethyl 4-(6-cyano-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl)butanoate Traditional Name: 4-(6-cyano-3-keto-2,2-dimethyl-1,4-benzoxazin-4-yl)butyric acid ethyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C2=C(C=CC(=C2)C#N)OC(C1=O)(C)C

Isomeric SMILES

CCOC(=O)CCCN1C2=C(C=CC(=C2)C#N)OC(C1=O)(C)C

InChI

InChI=1S/C17H20N2O4/c1-4-22-15(20)6-5-9-19-13-10-12(11-18)7-8-14(13)23-17(2,3)16(19)21/h7-8,10H,4-6,9H2,1-3H3