dimethyl 2-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-5-(cyclohexylamino)furan-3,4-dicarboxylate

Systemtic Name: dimethyl 2-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-5-(cyclohexylamino)furan-3,4-dicarboxylate Openeye Name: dimethyl 2-(6-chloro-4-oxo-chromen-3-yl)-5-(cyclohexylamino)furan-3,4-dicarboxylate CAS Name: 2-(6-chloro-4-oxo-1-benzopyran-3-yl)-5-(cyclohexylamino)furan-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(6-chloro-4-oxochromen-3-yl)-5-(cyclohexylamino)furan-3,4-dicarboxylate Traditional Name: 2-(6-chloro-4-keto-chromen-3-yl)-5-(cyclohexylamino)furan-3,4-dicarboxylic acid dimethyl ester Formula: C23H22ClNO7 MolecularWeight: 459.87628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC(=C1C(=O)OC)NC2CCCCC2)C3=COC4=C(C3=O)C=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=C(OC(=C1C(=O)OC)NC2CCCCC2)C3=COC4=C(C3=O)C=C(C=C4)Cl

InChI

InChI=1S/C23H22ClNO7/c1-29-22(27)17-18(23(28)30-2)21(25-13-6-4-3-5-7-13)32-20(17)15-11-31-16-9-8-12(24)10-14(16)19(15)26/h8-11,13,25H,3-7H2,1-2H3