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

Systemtic Name: ethyl 4-[[1-(phenylmethyl)benzimidazol-2-yl]amino]azepane-1-carboxylate Openeye Name: ethyl 4-[(1-benzylbenzimidazol-2-yl)amino]azepane-1-carboxylate CAS Name: 4-[[1-(phenylmethyl)-2-benzimidazolyl]amino]-1-azepanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-benzylbenzimidazol-2-yl)amino]azepane-1-carboxylate Traditional Name: 4-[(1-benzylbenzimidazol-2-yl)amino]azepane-1-carboxylic acid ethyl ester Formula: C23H28N4O2 MolecularWeight: 392.49402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(CC1)NC2=NC3=CC=CC=C3N2CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCCC(CC1)NC2=NC3=CC=CC=C3N2CC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2/c1-2-29-23(28)26-15-8-11-19(14-16-26)24-22-25-20-12-6-7-13-21(20)27(22)17-18-9-4-3-5-10-18/h3-7,9-10,12-13,19H,2,8,11,14-17H2,1H3,(H,24,25)