methyl (4E)-2-methyl-5-oxidanylidene-4-[(2-phenylmethoxyphenyl)methylidene]-1-(phenylmethyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4E)-2-methyl-5-oxidanylidene-4-[(2-phenylmethoxyphenyl)methylidene]-1-(phenylmethyl)pyrrole-3-carboxylate Openeye Name: methyl (4E)-1-benzyl-4-[(2-benzyloxyphenyl)methylene]-2-methyl-5-oxo-pyrrole-3-carboxylate CAS Name: (4E)-2-methyl-5-oxo-4-[(2-phenylmethoxyphenyl)methylidene]-1-(phenylmethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4E)-1-benzyl-2-methyl-5-oxo-4-[(2-phenylmethoxyphenyl)methylidene]pyrrole-3-carboxylate Traditional Name: (4E)-4-(2-benzoxybenzylidene)-1-benzyl-5-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=CC=CC=C2OCC3=CC=CC=C3)C(=O)N1CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(/C(=C\C2=CC=CC=C2OCC3=CC=CC=C3)/C(=O)N1CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C28H25NO4/c1-20-26(28(31)32-2)24(27(30)29(20)18-21-11-5-3-6-12-21)17-23-15-9-10-16-25(23)33-19-22-13-7-4-8-14-22/h3-17H,18-19H2,1-2H3/b24-17+