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

Systemtic Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-methyl-7-(octylamino)-2-oxidanyl-quinolin-4-one Openeye Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-hydroxy-1-methyl-7-(octylamino)quinolin-4-one CAS Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-hydroxy-1-methyl-7-(octylamino)-4-quinolinone IUPAC Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-hydroxy-1-methyl-7-(octylamino)quinolin-4-one Traditional Name: 3-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-hydroxy-1-methyl-7-(octylamino)-4-quinolone Formula: C28H42N2O3 MolecularWeight: 454.64468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=CC2=C(C=C1)C(=O)C(=C(N2C)O)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCNC1=CC2=C(C=C1)C(=O)C(=C(N2C)O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C28H42N2O3/c1-6-7-8-9-10-11-18-29-23-15-16-24-25(20-23)30(5)28(32)27(26(24)31)33-19-17-22(4)14-12-13-21(2)3/h13,15-17,20,29,32H,6-12,14,18-19H2,1-5H3/b22-17+