tert-butyl 1,4-diazepane-1-carboxylate hydrochloride

Systemtic Name: tert-butyl 1,4-diazepane-1-carboxylate hydrochloride Openeye Name: tert-butyl 1,4-diazepane-1-carboxylate hydrochloride CAS Name: 1,4-diazepane-1-carboxylic acid tert-butyl ester hydrochloride IUPAC Name: tert-butyl 1,4-diazepane-1-carboxylate hydrochloride Traditional Name: 1,4-diazepane-1-carboxylic acid tert-butyl ester hydrochloride Formula: C10H21ClN2O2 MolecularWeight: 236.73894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCNCC1.Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCNCC1.Cl

InChI

InChI=1S/C10H20N2O2.ClH/c1-10(2,3)14-9(13)12-7-4-5-11-6-8-12;/h11H,4-8H2,1-3H3;1H