[1-(phenylcarbonyl)-2,3,4,5-tetrahydroazepin-7-yl] benzoate

Systemtic Name: [1-(phenylcarbonyl)-2,3,4,5-tetrahydroazepin-7-yl] benzoate Openeye Name: (1-benzoyl-2,3,4,5-tetrahydroazepin-7-yl) benzoate CAS Name: benzoic acid (1-benzoyl-2,3,4,5-tetrahydroazepin-7-yl) ester IUPAC Name: (1-benzoyl-2,3,4,5-tetrahydroazepin-7-yl) benzoate Traditional Name: benzoic acid (1-benzoyl-2,3,4,5-tetrahydroazepin-7-yl) ester Formula: C20H19NO3 MolecularWeight: 321.36976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=CC1)OC(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(=CC1)OC(=O)C2=CC=CC=C2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H19NO3/c22-19(16-10-4-1-5-11-16)21-15-9-3-8-14-18(21)24-20(23)17-12-6-2-7-13-17/h1-2,4-7,10-14H,3,8-9,15H2