4-[(2S)-1-phenyl-3-phenylmethoxy-propan-2-yl]-1-[4-(trifluoromethyl)phenyl]carbonyl-1,4-diazepan-5-one

Systemtic Name: 4-[(2S)-1-phenyl-3-phenylmethoxy-propan-2-yl]-1-[4-(trifluoromethyl)phenyl]carbonyl-1,4-diazepan-5-one Openeye Name: 4-[(1S)-1-benzyl-2-benzyloxy-ethyl]-1-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-5-one CAS Name: 1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-4-[(2S)-1-phenyl-3-phenylmethoxypropan-2-yl]-1,4-diazepan-5-one IUPAC Name: 4-[(2S)-1-phenyl-3-phenylmethoxypropan-2-yl]-1-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-5-one Traditional Name: 4-[(1S)-1-(benzoxymethyl)-2-phenyl-ethyl]-1-[4-(trifluoromethyl)benzoyl]-1,4-diazepan-5-one Formula: C29H29F3N2O3 MolecularWeight: 510.54737

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)C(CC2=CC=CC=C2)COCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN(C1=O)[C@@H](CC2=CC=CC=C2)COCC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C29H29F3N2O3/c30-29(31,32)25-13-11-24(12-14-25)28(36)33-16-15-27(35)34(18-17-33)26(19-22-7-3-1-4-8-22)21-37-20-23-9-5-2-6-10-23/h1-14,26H,15-21H2/t26-/m0/s1