(4-ethanoylphenyl) 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate

Systemtic Name: (4-ethanoylphenyl) 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate Openeye Name: (4-acetylphenyl) 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate CAS Name: 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylic acid (4-acetylphenyl) ester IUPAC Name: (4-acetylphenyl) 3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxylate Traditional Name: 3-phenyl-6,7,8,9-tetrahydro-5H-imidaz[1,5-a]azepine-1-carboxylic acid (4-acetylphenyl) ester Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OC(=O)C2=C3CCCCCN3C(=N2)C4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OC(=O)C2=C3CCCCCN3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O3/c1-16(26)17-11-13-19(14-12-17)28-23(27)21-20-10-6-3-7-15-25(20)22(24-21)18-8-4-2-5-9-18/h2,4-5,8-9,11-14H,3,6-7,10,15H2,1H3