ethyl 2-[[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]-3-phenyl-propanoate Openeye Name: ethyl 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-anilino]-3-phenyl-propanoate CAS Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]-3-phenylpropanoate Traditional Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-anilino]-3-phenyl-propionic acid ethyl ester Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC2=CC(=C(C(=C2)C)OC3=CC(=C(C=C3)O)C(C)C)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC2=CC(=C(C(=C2)C)OC3=CC(=C(C=C3)O)C(C)C)C

InChI

InChI=1S/C28H33NO4/c1-6-32-28(31)25(16-21-10-8-7-9-11-21)29-22-14-19(4)27(20(5)15-22)33-23-12-13-26(30)24(17-23)18(2)3/h7-15,17-18,25,29-30H,6,16H2,1-5H3