tert-butyl 4-(1H-benzimidazol-2-yl)azepane-1-carboxylate

Systemtic Name: tert-butyl 4-(1H-benzimidazol-2-yl)azepane-1-carboxylate Openeye Name: tert-butyl 4-(1H-benzimidazol-2-yl)azepane-1-carboxylate CAS Name: 4-(1H-benzimidazol-2-yl)-1-azepanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1H-benzimidazol-2-yl)azepane-1-carboxylate Traditional Name: 4-(1H-benzimidazol-2-yl)azepane-1-carboxylic acid tert-butyl ester Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(CC1)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(CC1)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C18H25N3O2/c1-18(2,3)23-17(22)21-11-6-7-13(10-12-21)16-19-14-8-4-5-9-15(14)20-16/h4-5,8-9,13H,6-7,10-12H2,1-3H3,(H,19,20)