(2E,4E)-3-methyl-N-(2-methylpropyl)-12-(3-nitroquinolin-2-yl)oxy-dodeca-2,4-dienamide

Systemtic Name: (2E,4E)-3-methyl-N-(2-methylpropyl)-12-(3-nitroquinolin-2-yl)oxy-dodeca-2,4-dienamide Openeye Name: (2E,4E)-N-isobutyl-3-methyl-12-[(3-nitro-2-quinolyl)oxy]dodeca-2,4-dienamide CAS Name: (2E,4E)-3-methyl-N-(2-methylpropyl)-12-[(3-nitro-2-quinolinyl)oxy]dodeca-2,4-dienamide IUPAC Name: (2E,4E)-3-methyl-N-(2-methylpropyl)-12-(3-nitroquinolin-2-yl)oxydodeca-2,4-dienamide Traditional Name: (2E,4E)-N-isobutyl-3-methyl-12-[(3-nitro-2-quinolyl)oxy]dodeca-2,4-dienamide Formula: C26H35N3O4 MolecularWeight: 453.5738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C=C(C)C=CCCCCCCCOC1=NC2=CC=CC=C2C=C1[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)/C=C(\C)/C=C/CCCCCCCOC1=NC2=CC=CC=C2C=C1[N+](=O)[O-]

InChI

InChI=1S/C26H35N3O4/c1-20(2)19-27-25(30)17-21(3)13-9-7-5-4-6-8-12-16-33-26-24(29(31)32)18-22-14-10-11-15-23(22)28-26/h9-11,13-15,17-18,20H,4-8,12,16,19H2,1-3H3,(H,27,30)/b13-9+,21-17+