ethyl 4-[2-[(2-fluorophenyl)carbamoyl-(4-phenoxyphenyl)amino]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[2-[(2-fluorophenyl)carbamoyl-(4-phenoxyphenyl)amino]ethylamino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxy-anilino]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(N-[(2-fluoroanilino)-oxomethyl]-4-phenoxyanilino)ethylamino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxyanilino]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxy-anilino]ethylamino]-4-keto-butyric acid ethyl ester Formula: C27H28FN3O5 MolecularWeight: 493.526723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NCCN(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)NC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)CCC(=O)NCCN(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C27H28FN3O5/c1-2-35-26(33)17-16-25(32)29-18-19-31(27(34)30-24-11-7-6-10-23(24)28)20-12-14-22(15-13-20)36-21-8-4-3-5-9-21/h3-15H,2,16-19H2,1H3,(H,29,32)(H,30,34)