tert-butyl 4-(1-ethylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate

Systemtic Name: tert-butyl 4-(1-ethylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate Openeye Name: tert-butyl 4-(1-ethylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate CAS Name: 4-(1-ethyl-2-benzimidazolyl)-1,4-diazepane-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-ethylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(1-ethylbenzimidazol-2-yl)-1,4-diazepane-1-carboxylic acid tert-butyl ester Formula: C19H28N4O2 MolecularWeight: 344.45122

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1N3CCCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1N3CCCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H28N4O2/c1-5-23-16-10-7-6-9-15(16)20-17(23)21-11-8-12-22(14-13-21)18(24)25-19(2,3)4/h6-7,9-10H,5,8,11-14H2,1-4H3