4-butoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitro-quinolin-2-one

Systemtic Name: 4-butoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitro-quinolin-2-one Openeye Name: 4-butoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitro-quinolin-2-one CAS Name: 4-butoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitro-2-quinolinone IUPAC Name: 4-butoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitroquinolin-2-one Traditional Name: 4-butoxy-3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitro-carbostyril Formula: C25H34N2O5 MolecularWeight: 442.54786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])CC)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])CC)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C25H34N2O5/c1-6-8-15-31-23-21-13-12-20(27(29)30)17-22(21)26(7-2)25(28)24(23)32-16-14-19(5)11-9-10-18(3)4/h10,12-14,17H,6-9,11,15-16H2,1-5H3/b19-14+