[(1R)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate

Systemtic Name: [(1R)-2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate Openeye Name: [(1R)-2-(3-chloro-4-methoxy-anilino)-2-oxo-1-phenyl-ethyl] (E)-3-quinoxalin-2-ylprop-2-enoate CAS Name: (E)-3-(2-quinoxalinyl)-2-propenoic acid [(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(3-chloro-4-methoxyanilino)-2-oxo-1-phenylethyl] (E)-3-quinoxalin-2-ylprop-2-enoate Traditional Name: (E)-3-quinoxalin-2-ylacrylic acid [(1R)-2-(3-chloro-4-methoxy-anilino)-2-keto-1-phenyl-ethyl] ester Formula: C26H20ClN3O4 MolecularWeight: 473.9077

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=NC4=CC=CC=C4N=C3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)[C@@H](C2=CC=CC=C2)OC(=O)/C=C/C3=NC4=CC=CC=C4N=C3)Cl

InChI

InChI=1S/C26H20ClN3O4/c1-33-23-13-11-18(15-20(23)27)30-26(32)25(17-7-3-2-4-8-17)34-24(31)14-12-19-16-28-21-9-5-6-10-22(21)29-19/h2-16,25H,1H3,(H,30,32)/b14-12+/t25-/m1/s1