hexyl 2-[[2-chloranyl-5-cyano-3-[(2-hexoxy-2-oxidanylidene-ethanoyl)amino]phenyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: hexyl 2-[[2-chloranyl-5-cyano-3-[(2-hexoxy-2-oxidanylidene-ethanoyl)amino]phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: hexyl 2-[2-chloro-5-cyano-3-[(2-hexoxy-2-oxo-acetyl)amino]anilino]-2-oxo-acetate CAS Name: 2-[2-chloro-5-cyano-3-[(2-hexoxy-1,2-dioxoethyl)amino]anilino]-2-oxoacetic acid hexyl ester IUPAC Name: hexyl 2-[2-chloro-5-cyano-3-[(2-hexoxy-2-oxoacetyl)amino]anilino]-2-oxoacetate Traditional Name: 2-[2-chloro-5-cyano-3-[(2-hexoxy-2-keto-acetyl)amino]anilino]-2-keto-acetic acid hexyl ester Formula: C23H30ClN3O6 MolecularWeight: 479.9538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(=O)NC1=CC(=CC(=C1Cl)NC(=O)C(=O)OCCCCCC)C#N

Isomeric SMILES

CCCCCCOC(=O)C(=O)NC1=CC(=CC(=C1Cl)NC(=O)C(=O)OCCCCCC)C#N

InChI

InChI=1S/C23H30ClN3O6/c1-3-5-7-9-11-32-22(30)20(28)26-17-13-16(15-25)14-18(19(17)24)27-21(29)23(31)33-12-10-8-6-4-2/h13-14H,3-12H2,1-2H3,(H,26,28)(H,27,29)