(N,N'-dicyclohexylcarbamimidoyl) 6-chloranyl-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: (N,N'-dicyclohexylcarbamimidoyl) 6-chloranyl-2-oxidanylidene-chromene-3-carboxylate Openeye Name: (N,N'-dicyclohexylcarbamimidoyl) 6-chloro-2-oxo-chromene-3-carboxylate CAS Name: 6-chloro-2-oxo-1-benzopyran-3-carboxylic acid [(cyclohexylamino)-cyclohexyliminomethyl] ester IUPAC Name: (N,N'-dicyclohexylcarbamimidoyl) 6-chloro-2-oxochromene-3-carboxylate Traditional Name: 6-chloro-2-keto-chromene-3-carboxylic acid (N,N'-dicyclohexylamidino) ester Formula: C23H27ClN2O4 MolecularWeight: 430.92448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=NC2CCCCC2)OC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3=O

Isomeric SMILES

C1CCC(CC1)NC(=NC2CCCCC2)OC(=O)C3=CC4=C(C=CC(=C4)Cl)OC3=O

InChI

InChI=1S/C23H27ClN2O4/c24-16-11-12-20-15(13-16)14-19(21(27)29-20)22(28)30-23(25-17-7-3-1-4-8-17)26-18-9-5-2-6-10-18/h11-14,17-18H,1-10H2,(H,25,26)