(3S)-N-(1H-imidazol-2-ylmethyl)-N-(3-phenylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: (3S)-N-(1H-imidazol-2-ylmethyl)-N-(3-phenylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: (3S)-N-(1H-imidazol-2-ylmethyl)-N-(3-phenylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: (3S)-N-(1H-imidazol-2-ylmethyl)-N-(3-phenylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: (3S)-N-(1H-imidazol-2-ylmethyl)-N-(3-phenylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: (3S)-N-(1H-imidazol-2-ylmethyl)-N-(3-phenylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C25H21N3O3 MolecularWeight: 411.45254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)N(CC3=NC=CN3)C4=CC=CC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)N(CC3=NC=CN3)C4=CC=CC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O3/c29-25(23-17-30-21-11-4-5-12-22(21)31-23)28(16-24-26-13-14-27-24)20-10-6-9-19(15-20)18-7-2-1-3-8-18/h1-15,23H,16-17H2,(H,26,27)/t23-/m0/s1