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

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-methyl-7-nitro-3-octoxy-quinolin-2-one Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-methyl-7-nitro-3-octoxy-quinolin-2-one CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-methyl-7-nitro-3-octoxy-2-quinolinone IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-methyl-7-nitro-3-octoxyquinolin-2-one Traditional Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-methyl-7-nitro-3-octoxy-carbostyril Formula: C28H40N2O5 MolecularWeight: 484.6276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C2=C(C=C(C=C2)[N+](=O)[O-])N(C1=O)C)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCOC1=C(C2=C(C=C(C=C2)[N+](=O)[O-])N(C1=O)C)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C28H40N2O5/c1-6-7-8-9-10-11-18-34-27-26(35-19-17-22(4)14-12-13-21(2)3)24-16-15-23(30(32)33)20-25(24)29(5)28(27)31/h13,15-17,20H,6-12,14,18-19H2,1-5H3/b22-17+