(phenylmethyl) N-[(6R)-3-bromanyl-7-oxidanylidene-1,2,5,6-tetrahydroazepin-6-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(6R)-3-bromanyl-7-oxidanylidene-1,2,5,6-tetrahydroazepin-6-yl]carbamate Openeye Name: benzyl N-[(6R)-3-bromo-7-oxo-1,2,5,6-tetrahydroazepin-6-yl]carbamate CAS Name: N-[(6R)-3-bromo-7-oxo-1,2,5,6-tetrahydroazepin-6-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(6R)-3-bromo-7-oxo-1,2,5,6-tetrahydroazepin-6-yl]carbamate Traditional Name: N-[(6R)-3-bromo-7-keto-1,2,5,6-tetrahydroazepin-6-yl]carbamic acid benzyl ester Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(CNC(=O)C1NC(=O)OCC2=CC=CC=C2)Br

Isomeric SMILES

C1C=C(CNC(=O)[C@@H]1NC(=O)OCC2=CC=CC=C2)Br

InChI

InChI=1S/C14H15BrN2O3/c15-11-6-7-12(13(18)16-8-11)17-14(19)20-9-10-4-2-1-3-5-10/h1-6,12H,7-9H2,(H,16,18)(H,17,19)/t12-/m1/s1