7-bromanyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 7-bromanyl-4-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-1,4-benzoxazin-3-one Openeye Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-7-bromo-1,4-benzoxazin-3-one CAS Name: 7-bromo-4-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-7-bromo-1,4-benzoxazin-3-one Traditional Name: 4-[2-(4-benzylpiperazino)-2-keto-ethyl]-7-bromo-1,4-benzoxazin-3-one Formula: C21H22BrN3O3 MolecularWeight: 444.32168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H22BrN3O3/c22-17-6-7-18-19(12-17)28-15-21(27)25(18)14-20(26)24-10-8-23(9-11-24)13-16-4-2-1-3-5-16/h1-7,12H,8-11,13-15H2