ethyl 4-[(1-ethylbenzimidazol-2-yl)amino]azepane-1-carboxylate

Systemtic Name: ethyl 4-[(1-ethylbenzimidazol-2-yl)amino]azepane-1-carboxylate Openeye Name: ethyl 4-[(1-ethylbenzimidazol-2-yl)amino]azepane-1-carboxylate CAS Name: 4-[(1-ethyl-2-benzimidazolyl)amino]-1-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-ethylbenzimidazol-2-yl)amino]azepane-1-carboxylate Traditional Name: 4-[(1-ethylbenzimidazol-2-yl)amino]azepane-1-carboxylic acid ethyl ester Formula: C18H26N4O2 MolecularWeight: 330.42464

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1NC3CCCN(CC3)C(=O)OCC

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1NC3CCCN(CC3)C(=O)OCC

InChI

InChI=1S/C18H26N4O2/c1-3-22-16-10-6-5-9-15(16)20-17(22)19-14-8-7-12-21(13-11-14)18(23)24-4-2/h5-6,9-10,14H,3-4,7-8,11-13H2,1-2H3,(H,19,20)