2-(4,6-dimethylpyrimidin-2-yl)oxy-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]-3,3-diphenyl-propanoic acid

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)oxy-3-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]-3,3-diphenyl-propanoic acid Openeye Name: 3-[2-(benzylamino)-2-oxo-ethoxy]-2-(4,6-dimethylpyrimidin-2-yl)oxy-3,3-diphenyl-propanoic acid CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)oxy]-3-[2-oxo-2-[(phenylmethyl)amino]ethoxy]-3,3-diphenylpropanoic acid IUPAC Name: 3-[2-(benzylamino)-2-oxoethoxy]-2-(4,6-dimethylpyrimidin-2-yl)oxy-3,3-diphenylpropanoic acid Traditional Name: 3-[2-(benzylamino)-2-keto-ethoxy]-2-(4,6-dimethylpyrimidin-2-yl)oxy-3,3-diphenyl-propionic acid Formula: C30H29N3O5 MolecularWeight: 511.56836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)OC(C(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)OC(C(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C30H29N3O5/c1-21-18-22(2)33-29(32-21)38-27(28(35)36)30(24-14-8-4-9-15-24,25-16-10-5-11-17-25)37-20-26(34)31-19-23-12-6-3-7-13-23/h3-18,27H,19-20H2,1-2H3,(H,31,34)(H,35,36)