(5-bromanyl-2-chloranyl-phenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (5-bromanyl-2-chloranyl-phenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone Openeye Name: (5-bromo-2-chloro-phenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone CAS Name: (5-bromo-2-chlorophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (5-bromo-2-chlorophenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazin-1-yl]methanone Traditional Name: (5-bromo-2-chloro-phenyl)-[4-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)piperazino]methanone Formula: C20H20BrClN2O3 MolecularWeight: 451.7414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C(=O)C4=C(C=CC(=C4)Br)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCCO3)C(=O)C4=C(C=CC(=C4)Br)Cl

InChI

InChI=1S/C20H20BrClN2O3/c21-15-2-3-17(22)16(12-15)20(25)24-7-5-23(6-8-24)13-14-1-4-18-19(11-14)27-10-9-26-18/h1-4,11-12H,5-10,13H2