ethyl 2-methyl-4-(4-oxidanylidene-3,1-benzoxazin-2-yl)cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 2-methyl-4-(4-oxidanylidene-3,1-benzoxazin-2-yl)cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 2-methyl-4-(4-oxo-3,1-benzoxazin-2-yl)cyclohex-3-ene-1-carboxylate CAS Name: 2-methyl-4-(4-oxo-3,1-benzoxazin-2-yl)-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(4-oxo-3,1-benzoxazin-2-yl)cyclohex-3-ene-1-carboxylate Traditional Name: 4-(4-keto-3,1-benzoxazin-2-yl)-2-methyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C18H19NO4 MolecularWeight: 313.34776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=CC1C)C2=NC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCOC(=O)C1CCC(=CC1C)C2=NC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C18H19NO4/c1-3-22-17(20)13-9-8-12(10-11(13)2)16-19-15-7-5-4-6-14(15)18(21)23-16/h4-7,10-11,13H,3,8-9H2,1-2H3