tert-butyl 4-(4-azanylbutyl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(4-azanylbutyl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(4-aminobutyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(4-aminobutyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-aminobutyl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(4-aminobutyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C14H29N3O2 MolecularWeight: 271.39896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CC1)CCCCN

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC1)CCCCN

InChI

InChI=1S/C14H29N3O2/c1-14(2,3)19-13(18)17-10-6-9-16(11-12-17)8-5-4-7-15/h4-12,15H2,1-3H3