(phenylmethyl) 2-(2-methanoyl-4-phenylmethoxy-phenyl)-5-(2-methylpropylcarbamoyl)benzoate

Systemtic Name: (phenylmethyl) 2-(2-methanoyl-4-phenylmethoxy-phenyl)-5-(2-methylpropylcarbamoyl)benzoate Openeye Name: benzyl 2-(4-benzyloxy-2-formyl-phenyl)-5-(isobutylcarbamoyl)benzoate CAS Name: 2-(2-formyl-4-phenylmethoxyphenyl)-5-[(2-methylpropylamino)-oxomethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2-formyl-4-phenylmethoxyphenyl)-5-(2-methylpropylcarbamoyl)benzoate Traditional Name: 2-(4-benzoxy-2-formyl-phenyl)-5-(isobutylcarbamoyl)benzoic acid benzyl ester Formula: C33H31NO5 MolecularWeight: 521.60294

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C=O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C=O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H31NO5/c1-23(2)19-34-32(36)26-13-15-30(31(18-26)33(37)39-22-25-11-7-4-8-12-25)29-16-14-28(17-27(29)20-35)38-21-24-9-5-3-6-10-24/h3-18,20,23H,19,21-22H2,1-2H3,(H,34,36)