2-bromanyl-N1,N3-bis[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]benzene-1,3-dicarboxamide

Systemtic Name: 2-bromanyl-N1,N3-bis[(2S)-1-oxidanyl-3-phenyl-propan-2-yl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[(1S)-1-benzyl-2-hydroxy-ethyl]-2-bromo-benzene-1,3-dicarboxamide CAS Name: 2-bromo-N1,N3-bis[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzene-1,3-dicarboxamide IUPAC Name: 2-bromo-1-N,3-N-bis[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[(1S)-1-benzyl-2-hydroxy-ethyl]-2-bromo-isophthalamide Formula: C26H27BrN2O4 MolecularWeight: 511.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CO)NC(=O)C2=C(C(=CC=C2)C(=O)NC(CC3=CC=CC=C3)CO)Br

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](CO)NC(=O)C2=C(C(=CC=C2)C(=O)N[C@@H](CC3=CC=CC=C3)CO)Br

InChI

InChI=1S/C26H27BrN2O4/c27-24-22(25(32)28-20(16-30)14-18-8-3-1-4-9-18)12-7-13-23(24)26(33)29-21(17-31)15-19-10-5-2-6-11-19/h1-13,20-21,30-31H,14-17H2,(H,28,32)(H,29,33)/t20-,21-/m0/s1