ethyl 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylate

Systemtic Name: ethyl 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylate Openeye Name: ethyl 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylate CAS Name: 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylate Traditional Name: 4-(1H-benzimidazol-2-yl)-1,4-diazepane-1-carboxylic acid ethyl ester Formula: C15H20N4O2 MolecularWeight: 288.3449

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)N1CCCN(CC1)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C15H20N4O2/c1-2-21-15(20)19-9-5-8-18(10-11-19)14-16-12-6-3-4-7-13(12)17-14/h3-4,6-7H,2,5,8-11H2,1H3,(H,16,17)