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

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(2S)-4-methyl-1-oxidanyl-pentan-2-yl]-1,4-diazepan-5-one Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(1S)-1-(hydroxymethyl)-3-methyl-butyl]-1,4-diazepan-5-one CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-1,4-diazepan-5-one IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-1,4-diazepan-5-one Traditional Name: 4-[(1S)-3-methyl-1-methylol-butyl]-1-veratryl-1,4-diazepan-5-one Formula: C20H32N2O4 MolecularWeight: 364.47908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CO)N1CCN(CCC1=O)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)C[C@@H](CO)N1CCN(CCC1=O)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C20H32N2O4/c1-15(2)11-17(14-23)22-10-9-21(8-7-20(22)24)13-16-5-6-18(25-3)19(12-16)26-4/h5-6,12,15,17,23H,7-11,13-14H2,1-4H3/t17-/m0/s1