4-bromanyl-1-[[4-(2-phenylethanoyl)piperazin-1-yl]methyl]indole-2,3-dione

Systemtic Name: 4-bromanyl-1-[[4-(2-phenylethanoyl)piperazin-1-yl]methyl]indole-2,3-dione Openeye Name: 4-bromo-1-[[4-(2-phenylacetyl)piperazin-1-yl]methyl]indoline-2,3-dione CAS Name: 4-bromo-1-[[4-(1-oxo-2-phenylethyl)-1-piperazinyl]methyl]indole-2,3-dione IUPAC Name: 4-bromo-1-[[4-(2-phenylacetyl)piperazin-1-yl]methyl]indole-2,3-dione Traditional Name: 4-bromo-1-[[4-(2-phenylacetyl)piperazino]methyl]isatin Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C(=CC=C3)Br)C(=O)C2=O)C(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CN2C3=C(C(=CC=C3)Br)C(=O)C2=O)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H20BrN3O3/c22-16-7-4-8-17-19(16)20(27)21(28)25(17)14-23-9-11-24(12-10-23)18(26)13-15-5-2-1-3-6-15/h1-8H,9-14H2