(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 4-[2-[(5-chloranyl-2-methoxy-phenyl)amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 4-[2-(5-chloro-2-methoxy-anilino)-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]-3-methoxybenzoic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 4-[2-(5-chloro-2-methoxyanilino)-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-(5-chloro-2-methoxy-anilino)-2-keto-ethoxy]-3-methoxy-benzoic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C23H22ClN3O7 MolecularWeight: 487.88968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)Cl)OC)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)C1=CC(=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)Cl)OC)OC

InChI

InChI=1S/C23H22ClN3O7/c1-13(26)16(10-25)18(28)11-34-23(30)14-4-6-20(21(8-14)32-3)33-12-22(29)27-17-9-15(24)5-7-19(17)31-2/h4-9,16,26H,11-12H2,1-3H3,(H,27,29)