2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-1-(4-nitrophenyl)-3-[4-(phenylmethyl)piperidin-1-yl]propane-1,3-dione

Systemtic Name: 2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-1-(4-nitrophenyl)-3-[4-(phenylmethyl)piperidin-1-yl]propane-1,3-dione Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(5-bromo-2-oxo-1-pyridyl)-3-(4-nitrophenyl)propane-1,3-dione CAS Name: 2-(5-bromo-2-oxo-1-pyridinyl)-1-(4-nitrophenyl)-3-[4-(phenylmethyl)-1-piperidinyl]propane-1,3-dione IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(5-bromo-2-oxopyridin-1-yl)-3-(4-nitrophenyl)propane-1,3-dione Traditional Name: 1-(4-benzylpiperidino)-2-(5-bromo-2-keto-1-pyridyl)-3-(4-nitrophenyl)propane-1,3-dione Formula: C26H24BrN3O5 MolecularWeight: 538.38986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C(C(=O)C3=CC=C(C=C3)[N+](=O)[O-])N4C=C(C=CC4=O)Br

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C(C(=O)C3=CC=C(C=C3)[N+](=O)[O-])N4C=C(C=CC4=O)Br

InChI

InChI=1S/C26H24BrN3O5/c27-21-8-11-23(31)29(17-21)24(25(32)20-6-9-22(10-7-20)30(34)35)26(33)28-14-12-19(13-15-28)16-18-4-2-1-3-5-18/h1-11,17,19,24H,12-16H2