4-[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-1-(3-phenylpropyl)-1,4-diazepan-5-one

Systemtic Name: 4-[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-1-(3-phenylpropyl)-1,4-diazepan-5-one Openeye Name: 4-[(1S)-1-(hydroxymethyl)-3-methyl-butyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one CAS Name: 4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-1-(3-phenylpropyl)-1,4-diazepan-5-one IUPAC Name: 4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-1-(3-phenylpropyl)-1,4-diazepan-5-one Traditional Name: 4-[(1S)-3-methyl-1-methylol-butyl]-1-(3-phenylpropyl)-1,4-diazepan-5-one Formula: C20H32N2O2 MolecularWeight: 332.48028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)N1CCN(CCC1=O)CCCC2=CC=CC=C2

Isomeric SMILES

CC(C)C[C@@H](CO)N1CCN(CCC1=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C20H32N2O2/c1-17(2)15-19(16-23)22-14-13-21(12-10-20(22)24)11-6-9-18-7-4-3-5-8-18/h3-5,7-8,17,19,23H,6,9-16H2,1-2H3/t19-/m0/s1