phenyl 1,4,5,7,8,9-hexahydroimidazo[4,5-d]azocine-6-carboxylate

Systemtic Name: phenyl 1,4,5,7,8,9-hexahydroimidazo[4,5-d]azocine-6-carboxylate Openeye Name: phenyl 1,4,5,7,8,9-hexahydroimidazo[4,5-d]azocine-6-carboxylate CAS Name: 1,4,5,7,8,9-hexahydroimidazo[4,5-d]azocine-6-carboxylic acid phenyl ester IUPAC Name: phenyl 1,4,5,7,8,9-hexahydroimidazo[4,5-d]azocine-6-carboxylate Traditional Name: 1,4,5,7,8,9-hexahydroimidaz[4,5-d]azocine-6-carboxylic acid phenyl ester Formula: C15H17N3O2 MolecularWeight: 271.31438

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CCN(C1)C(=O)OC3=CC=CC=C3)N=CN2

Isomeric SMILES

C1CC2=C(CCN(C1)C(=O)OC3=CC=CC=C3)N=CN2

InChI

InChI=1S/C15H17N3O2/c19-15(20-12-5-2-1-3-6-12)18-9-4-7-13-14(8-10-18)17-11-16-13/h1-3,5-6,11H,4,7-10H2,(H,16,17)