[(1R)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-ethoxy-3-methoxy-benzoate

Systemtic Name: [(1R)-2-[(2-methoxy-5-methyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 4-ethoxy-3-methoxy-benzoate Openeye Name: [(1R)-2-(2-methoxy-5-methyl-anilino)-2-oxo-1-phenyl-ethyl] 4-ethoxy-3-methoxy-benzoate CAS Name: 4-ethoxy-3-methoxybenzoic acid [(1R)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl] 4-ethoxy-3-methoxybenzoate Traditional Name: 4-ethoxy-3-methoxy-benzoic acid [(1R)-2-keto-2-(2-methoxy-5-methyl-anilino)-1-phenyl-ethyl] ester Formula: C26H27NO6 MolecularWeight: 449.49568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C)OC)OC

InChI

InChI=1S/C26H27NO6/c1-5-32-22-14-12-19(16-23(22)31-4)26(29)33-24(18-9-7-6-8-10-18)25(28)27-20-15-17(2)11-13-21(20)30-3/h6-16,24H,5H2,1-4H3,(H,27,28)/t24-/m1/s1