tert-butyl 4-pyridin-3-yl-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-pyridin-3-yl-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(3-pyridyl)-1,4-diazepane-1-carboxylate CAS Name: 4-(3-pyridinyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-pyridin-3-yl-1,4-diazepane-1-carboxylate Traditional Name: 4-(3-pyridyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C15H23N3O2 MolecularWeight: 277.36202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCN(CC1)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCN(CC1)C2=CN=CC=C2

InChI

InChI=1S/C15H23N3O2/c1-15(2,3)20-14(19)18-9-5-8-17(10-11-18)13-6-4-7-16-12-13/h4,6-7,12H,5,8-11H2,1-3H3