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

Systemtic Name: phenethyl 1,4,5,7,8,9-hexahydroimidazo[4,5-d]azocine-6-carboxylate Openeye Name: phenethyl 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 phenethyl ester IUPAC Name: phenethyl 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 phenethyl ester Formula: C17H21N3O2 MolecularWeight: 299.36754

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CCN(C1)C(=O)OCCC3=CC=CC=C3)N=CN2

Isomeric SMILES

C1CC2=C(CCN(C1)C(=O)OCCC3=CC=CC=C3)N=CN2

InChI

InChI=1S/C17H21N3O2/c21-17(22-12-9-14-5-2-1-3-6-14)20-10-4-7-15-16(8-11-20)19-13-18-15/h1-3,5-6,13H,4,7-12H2,(H,18,19)