[(1R)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-phenoxybenzoate

Systemtic Name: [(1R)-2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-phenoxybenzoate Openeye Name: [(1R)-2-(2,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] 3-phenoxybenzoate CAS Name: 3-phenoxybenzoic acid [(1R)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(2,5-dimethylanilino)-2-oxo-1-phenylethyl] 3-phenoxybenzoate Traditional Name: 3-phenoxybenzoic acid [(1R)-2-(2,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C29H25NO4 MolecularWeight: 451.5131

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)[C@@H](C2=CC=CC=C2)OC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C29H25NO4/c1-20-16-17-21(2)26(18-20)30-28(31)27(22-10-5-3-6-11-22)34-29(32)23-12-9-15-25(19-23)33-24-13-7-4-8-14-24/h3-19,27H,1-2H3,(H,30,31)/t27-/m1/s1