3-[[2-[(4-cyanophenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)ethanoyl]amino]benzoate

Systemtic Name: 3-[[2-[(4-cyanophenyl)amino]-2-(3-methoxy-4-phenylmethoxy-phenyl)ethanoyl]amino]benzoate Openeye Name: 3-[[2-(4-benzyloxy-3-methoxy-phenyl)-2-(4-cyanoanilino)acetyl]amino]benzoate CAS Name: 3-[[2-(4-cyanoanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)-1-oxoethyl]amino]benzoate IUPAC Name: 3-[[2-(4-cyanoanilino)-2-(3-methoxy-4-phenylmethoxyphenyl)acetyl]amino]benzoate Traditional Name: 3-[[2-(4-benzoxy-3-methoxy-phenyl)-2-(4-cyanoanilino)acetyl]amino]benzoate Formula: C30H24N3O5- MolecularWeight: 506.52866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(C(=O)NC2=CC=CC(=C2)C(=O)[O-])NC3=CC=C(C=C3)C#N)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C(C(=O)NC2=CC=CC(=C2)C(=O)[O-])NC3=CC=C(C=C3)C#N)OCC4=CC=CC=C4

InChI

InChI=1S/C30H25N3O5/c1-37-27-17-22(12-15-26(27)38-19-21-6-3-2-4-7-21)28(32-24-13-10-20(18-31)11-14-24)29(34)33-25-9-5-8-23(16-25)30(35)36/h2-17,28,32H,19H2,1H3,(H,33,34)(H,35,36)/p-1