tert-butyl 4-(2-oxidanylpropyl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(2-oxidanylpropyl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(2-hydroxypropyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(2-hydroxypropyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-hydroxypropyl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(2-hydroxypropyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C13H26N2O3 MolecularWeight: 258.35714

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCCN(CC1)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC(CN1CCCN(CC1)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C13H26N2O3/c1-11(16)10-14-6-5-7-15(9-8-14)12(17)18-13(2,3)4/h11,16H,5-10H2,1-4H3