[(1-ethylbenzimidazol-2-yl)amino] azepane-1-carboxylate

Systemtic Name: [(1-ethylbenzimidazol-2-yl)amino] azepane-1-carboxylate Openeye Name: [(1-ethylbenzimidazol-2-yl)amino] azepane-1-carboxylate CAS Name: 1-azepanecarboxylic acid [(1-ethyl-2-benzimidazolyl)amino] ester IUPAC Name: [(1-ethylbenzimidazol-2-yl)amino] azepane-1-carboxylate Traditional Name: azepane-1-carboxylic acid [(1-ethylbenzimidazol-2-yl)amino] ester Formula: C16H22N4O2 MolecularWeight: 302.37148

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1NOC(=O)N3CCCCCC3

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1NOC(=O)N3CCCCCC3

InChI

InChI=1S/C16H22N4O2/c1-2-20-14-10-6-5-9-13(14)17-15(20)18-22-16(21)19-11-7-3-4-8-12-19/h5-6,9-10H,2-4,7-8,11-12H2,1H3,(H,17,18)