4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-3-prop-2-enoxy-quinolin-2-one

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-3-prop-2-enoxy-quinolin-2-one Openeye Name: 3-allyloxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-quinolin-2-one CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-3-prop-2-enoxy-2-quinolinone IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-3-prop-2-enoxyquinolin-2-one Traditional Name: 3-allyloxy-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-7-nitro-carbostyril Formula: C28H38N2O5 MolecularWeight: 482.61172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC=C)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC=C)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C28H38N2O5/c1-6-8-9-10-17-29-25-20-23(30(32)33)14-15-24(25)26(27(28(29)31)34-18-7-2)35-19-16-22(5)13-11-12-21(3)4/h7,12,14-16,20H,2,6,8-11,13,17-19H2,1,3-5H3/b22-16+