2-[4-(6-bromanyl-3-nitro-quinolin-4-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(6-bromanyl-3-nitro-quinolin-4-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(6-bromo-3-nitro-4-quinolyl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-(6-bromo-3-nitro-4-quinolinyl)-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(6-bromo-3-nitroquinolin-4-yl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(6-bromo-3-nitro-4-quinolyl)piperazino]-1-pyrrolidino-ethanone Formula: C19H22BrN5O3 MolecularWeight: 448.31368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C3=C4C=C(C=CC4=NC=C3[N+](=O)[O-])Br

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C3=C4C=C(C=CC4=NC=C3[N+](=O)[O-])Br

InChI

InChI=1S/C19H22BrN5O3/c20-14-3-4-16-15(11-14)19(17(12-21-16)25(27)28)24-9-7-22(8-10-24)13-18(26)23-5-1-2-6-23/h3-4,11-12H,1-2,5-10,13H2