N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-[(4-cyanophenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[4-(4-cyanobenzyl)piperazino]acetamide Formula: C22H23BrN4O3 MolecularWeight: 471.34702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C22H23BrN4O3/c23-18-11-20-21(30-10-9-29-20)12-19(18)25-22(28)15-27-7-5-26(6-8-27)14-17-3-1-16(13-24)2-4-17/h1-4,11-12H,5-10,14-15H2,(H,25,28)