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

Systemtic Name: [7-azanyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-octyl-2-oxidanylidene-quinolin-3-yl] ethanoate Openeye Name: [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-octyl-2-oxo-3-quinolyl] acetate CAS Name: acetic acid [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-octyl-2-oxo-3-quinolinyl] ester IUPAC Name: [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-1-octyl-2-oxoquinolin-3-yl] acetate Traditional Name: acetic acid [7-amino-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-2-keto-1-octyl-3-quinolyl] ester Formula: C29H42N2O4 MolecularWeight: 482.65478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)N)C(=C(C1=O)OC(=O)C)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)N)C(=C(C1=O)OC(=O)C)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C29H42N2O4/c1-6-7-8-9-10-11-18-31-26-20-24(30)15-16-25(26)27(28(29(31)33)35-23(5)32)34-19-17-22(4)14-12-13-21(2)3/h13,15-17,20H,6-12,14,18-19,30H2,1-5H3/b22-17+