(N,N'-dicyclohexylcarbamimidoyl) 5,7-dimethoxy-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: (N,N'-dicyclohexylcarbamimidoyl) 5,7-dimethoxy-2-oxidanylidene-chromene-3-carboxylate Openeye Name: (N,N'-dicyclohexylcarbamimidoyl) 5,7-dimethoxy-2-oxo-chromene-3-carboxylate CAS Name: 5,7-dimethoxy-2-oxo-1-benzopyran-3-carboxylic acid [(cyclohexylamino)-cyclohexyliminomethyl] ester IUPAC Name: (N,N'-dicyclohexylcarbamimidoyl) 5,7-dimethoxy-2-oxochromene-3-carboxylate Traditional Name: 2-keto-5,7-dimethoxy-chromene-3-carboxylic acid (N,N'-dicyclohexylamidino) ester Formula: C25H32N2O6 MolecularWeight: 456.53138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C=C(C(=O)OC2=C1)C(=O)OC(=NC3CCCCC3)NC4CCCCC4)OC

Isomeric SMILES

COC1=CC(=C2C=C(C(=O)OC2=C1)C(=O)OC(=NC3CCCCC3)NC4CCCCC4)OC

InChI

InChI=1S/C25H32N2O6/c1-30-18-13-21(31-2)19-15-20(23(28)32-22(19)14-18)24(29)33-25(26-16-9-5-3-6-10-16)27-17-11-7-4-8-12-17/h13-17H,3-12H2,1-2H3,(H,26,27)