ethyl 2-[4-chloranyl-2-(ethoxycarbonylamino)phenyl]carbonyl-3-oxidanylidene-3-phenyl-propanoate

Systemtic Name: ethyl 2-[4-chloranyl-2-(ethoxycarbonylamino)phenyl]carbonyl-3-oxidanylidene-3-phenyl-propanoate Openeye Name: ethyl 2-benzoyl-3-[4-chloro-2-(ethoxycarbonylamino)phenyl]-3-oxo-propanoate CAS Name: 2-benzoyl-3-[4-chloro-2-(ethoxycarbonylamino)phenyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 2-benzoyl-3-[4-chloro-2-(ethoxycarbonylamino)phenyl]-3-oxopropanoate Traditional Name: 2-benzoyl-3-[2-(carbethoxyamino)-4-chloro-phenyl]-3-keto-propionic acid ethyl ester Formula: C21H20ClNO6 MolecularWeight: 417.8396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1=CC=CC=C1)C(=O)C2=C(C=C(C=C2)Cl)NC(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(=O)C1=CC=CC=C1)C(=O)C2=C(C=C(C=C2)Cl)NC(=O)OCC

InChI

InChI=1S/C21H20ClNO6/c1-3-28-20(26)17(18(24)13-8-6-5-7-9-13)19(25)15-11-10-14(22)12-16(15)23-21(27)29-4-2/h5-12,17H,3-4H2,1-2H3,(H,23,27)