dimethyl 5'-cyclohexylimino-3-oxidanylidene-spiro[2-benzofuran-1,2'-furan]-3',4'-dicarboxylate

Systemtic Name: dimethyl 5'-cyclohexylimino-3-oxidanylidene-spiro[2-benzofuran-1,2'-furan]-3',4'-dicarboxylate Openeye Name: dimethyl 5-cyclohexylimino-3'-oxo-spiro[furan-2,1'-isobenzofuran]-3,4-dicarboxylate CAS Name: 5-cyclohexylimino-3'-oxospiro[furan-2,1'-isobenzofuran]-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5'-cyclohexylimino-3-oxospiro[2-benzofuran-1,2'-furan]-3',4'-dicarboxylate Traditional Name: 5-cyclohexylimino-3'-keto-spiro[furan-2,1'-phthalan]-3,4-dicarboxylic acid dimethyl ester Formula: C21H21NO7 MolecularWeight: 399.39394

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2(C3=CC=CC=C3C(=O)O2)OC1=NC4CCCCC4)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C2(C3=CC=CC=C3C(=O)O2)OC1=NC4CCCCC4)C(=O)OC

InChI

InChI=1S/C21H21NO7/c1-26-19(24)15-16(20(25)27-2)21(14-11-7-6-10-13(14)18(23)29-21)28-17(15)22-12-8-4-3-5-9-12/h6-7,10-12H,3-5,8-9H2,1-2H3