N-[3-[(3-cyanophenyl)methyl]-4-oxidanyl-1-phenyl-butan-2-yl]-4-(4-phenylmethoxyphenyl)benzamide

Systemtic Name: N-[3-[(3-cyanophenyl)methyl]-4-oxidanyl-1-phenyl-butan-2-yl]-4-(4-phenylmethoxyphenyl)benzamide Openeye Name: N-[1-benzyl-2-[(3-cyanophenyl)methyl]-3-hydroxy-propyl]-4-(4-benzyloxyphenyl)benzamide CAS Name: N-[3-[(3-cyanophenyl)methyl]-4-hydroxy-1-phenylbutan-2-yl]-4-(4-phenylmethoxyphenyl)benzamide IUPAC Name: N-[3-[(3-cyanophenyl)methyl]-4-hydroxy-1-phenylbutan-2-yl]-4-(4-phenylmethoxyphenyl)benzamide Traditional Name: 4-(4-benzoxyphenyl)-N-[1-benzyl-2-(3-cyanobenzyl)-3-hydroxy-propyl]benzamide Formula: C38H34N2O3 MolecularWeight: 566.68816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CC2=CC=CC(=C2)C#N)CO)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC(C(CC2=CC=CC(=C2)C#N)CO)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C38H34N2O3/c39-25-31-13-7-12-30(22-31)23-35(26-41)37(24-28-8-3-1-4-9-28)40-38(42)34-16-14-32(15-17-34)33-18-20-36(21-19-33)43-27-29-10-5-2-6-11-29/h1-22,35,37,41H,23-24,26-27H2,(H,40,42)