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

Systemtic Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-7-nitro-2-oxidanyl-quinolin-4-one Openeye Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-2-hydroxy-7-nitro-quinolin-4-one CAS Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-2-hydroxy-7-nitro-4-quinolinone IUPAC Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-2-hydroxy-7-nitroquinolin-4-one Traditional Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-ethyl-2-hydroxy-7-nitro-4-quinolone Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C21H26N2O5/c1-5-22-18-13-16(23(26)27)9-10-17(18)19(24)20(21(22)25)28-12-11-15(4)8-6-7-14(2)3/h7,9-11,13,25H,5-6,8,12H2,1-4H3/b15-11+