5-bromanyl-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzaldehyde

Systemtic Name: 5-bromanyl-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethoxy]benzaldehyde Openeye Name: 2-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethoxy]-5-bromo-benzaldehyde CAS Name: 5-bromo-2-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethoxy]benzaldehyde IUPAC Name: 2-[2-(4-benzylpiperazin-1-yl)-2-oxoethoxy]-5-bromobenzaldehyde Traditional Name: 2-[2-(4-benzylpiperazino)-2-keto-ethoxy]-5-bromo-benzaldehyde Formula: C20H21BrN2O3 MolecularWeight: 417.29634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC3=C(C=C(C=C3)Br)C=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC3=C(C=C(C=C3)Br)C=O

InChI

InChI=1S/C20H21BrN2O3/c21-18-6-7-19(17(12-18)14-24)26-15-20(25)23-10-8-22(9-11-23)13-16-4-2-1-3-5-16/h1-7,12,14H,8-11,13,15H2