N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanamide

Systemtic Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-oxidanylidene-2,3-dihydro-1,5-benzoxazepin-5-yl)ethanamide Openeye Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide CAS Name: N-[2-[(4-bromophenyl)methyl]-3-pyrazolyl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide IUPAC Name: N-[2-[(4-bromophenyl)methyl]pyrazol-3-yl]-2-(4-oxo-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide Traditional Name: N-[2-(4-bromobenzyl)pyrazol-3-yl]-2-(4-keto-2,3-dihydro-1,5-benzoxazepin-5-yl)acetamide Formula: C21H19BrN4O3 MolecularWeight: 455.30456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

Isomeric SMILES

C1COC2=CC=CC=C2N(C1=O)CC(=O)NC3=CC=NN3CC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O3/c22-16-7-5-15(6-8-16)13-26-19(9-11-23-26)24-20(27)14-25-17-3-1-2-4-18(17)29-12-10-21(25)28/h1-9,11H,10,12-14H2,(H,24,27)