methyl 2-[2-(2-methoxyethoxymethoxycarbonyl)-4-phenylmethoxy-phenyl]-5-(3-methylbutanoylamino)benzoate

Systemtic Name: methyl 2-[2-(2-methoxyethoxymethoxycarbonyl)-4-phenylmethoxy-phenyl]-5-(3-methylbutanoylamino)benzoate Openeye Name: methyl 2-[4-benzyloxy-2-(2-methoxyethoxymethoxycarbonyl)phenyl]-5-(3-methylbutanoylamino)benzoate CAS Name: 2-[2-[2-methoxyethoxymethoxy(oxo)methyl]-4-phenylmethoxyphenyl]-5-[(3-methyl-1-oxobutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-(2-methoxyethoxymethoxycarbonyl)-4-phenylmethoxyphenyl]-5-(3-methylbutanoylamino)benzoate Traditional Name: 2-[4-benzoxy-2-(2-methoxyethoxymethoxycarbonyl)phenyl]-5-(isovalerylamino)benzoic acid methyl ester Formula: C31H35NO8 MolecularWeight: 549.6115

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C(=O)OCOCCOC)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C(=O)OCOCCOC)C(=O)OC

InChI

InChI=1S/C31H35NO8/c1-21(2)16-29(33)32-23-10-12-25(27(17-23)30(34)37-4)26-13-11-24(39-19-22-8-6-5-7-9-22)18-28(26)31(35)40-20-38-15-14-36-3/h5-13,17-18,21H,14-16,19-20H2,1-4H3,(H,32,33)