4-[(1S)-2-oxidanyl-1-phenyl-ethyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one

Systemtic Name: 4-[(1S)-2-oxidanyl-1-phenyl-ethyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one Openeye Name: 4-[(1S)-2-hydroxy-1-phenyl-ethyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one CAS Name: 4-[(1S)-2-hydroxy-1-phenylethyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one IUPAC Name: 4-[(1S)-2-hydroxy-1-phenylethyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one Traditional Name: 4-[(1S)-2-hydroxy-1-phenyl-ethyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)C(CO)C2=CC=CC=C2)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)[C@H](CO)C2=CC=CC=C2)CCCC3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c25-18-21(20-11-5-2-6-12-20)24-17-16-23(15-13-22(24)26)14-7-10-19-8-3-1-4-9-19/h1-6,8-9,11-12,21,25H,7,10,13-18H2/t21-/m1/s1