1-[4-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]-1,4-diazepan-1-yl]ethanone

Systemtic Name: 1-[4-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[4-[(2S)-3-benzyloxy-2-hydroxy-propyl]-1,4-diazepan-1-yl]ethanone CAS Name: 1-[4-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-1,4-diazepan-1-yl]ethanone IUPAC Name: 1-[4-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-1,4-diazepan-1-yl]ethanone Traditional Name: 1-[4-[(2S)-3-benzoxy-2-hydroxy-propyl]-1,4-diazepan-1-yl]ethanone Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)CC(COCC2=CC=CC=C2)O

Isomeric SMILES

CC(=O)N1CCCN(CC1)C[C@@H](COCC2=CC=CC=C2)O

InChI

InChI=1S/C17H26N2O3/c1-15(20)19-9-5-8-18(10-11-19)12-17(21)14-22-13-16-6-3-2-4-7-16/h2-4,6-7,17,21H,5,8-14H2,1H3/t17-/m0/s1