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

Systemtic Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-methyl-7-nitro-quinolin-2-one Openeye Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-methyl-7-nitro-quinolin-2-one CAS Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-methyl-7-nitro-2-quinolinone IUPAC Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-methyl-7-nitroquinolin-2-one Traditional Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-4-hexoxy-1-methyl-7-nitro-carbostyril Formula: C26H36N2O5 MolecularWeight: 456.57444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])C)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])C)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C26H36N2O5/c1-6-7-8-9-16-32-24-22-14-13-21(28(30)31)18-23(22)27(5)26(29)25(24)33-17-15-20(4)12-10-11-19(2)3/h11,13-15,18H,6-10,12,16-17H2,1-5H3/b20-15+