[7-azanyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-oxidanylidene-quinolin-3-yl] ethanoate

Systemtic Name: [7-azanyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-oxidanylidene-quinolin-3-yl] ethanoate Openeye Name: [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-oxo-3-quinolyl] acetate CAS Name: acetic acid [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-oxo-3-quinolinyl] ester IUPAC Name: [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-oxoquinolin-3-yl] acetate Traditional Name: acetic acid [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-hexyl-2-keto-3-quinolyl] ester Formula: C27H38N2O4 MolecularWeight: 454.60162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)N)C(=C(C1=O)OC(=O)C)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)N)C(=C(C1=O)OC(=O)C)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C27H38N2O4/c1-6-7-8-9-16-29-24-18-22(28)13-14-23(24)25(26(27(29)31)33-21(5)30)32-17-15-20(4)12-10-11-19(2)3/h11,13-15,18H,6-10,12,16-17,28H2,1-5H3/b20-15+