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

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-(2-methylpentoxy)-7-nitro-1-octyl-quinolin-2-one Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-(2-methylpentoxy)-7-nitro-1-octyl-quinolin-2-one CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-(2-methylpentoxy)-7-nitro-1-octyl-2-quinolinone IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-(2-methylpentoxy)-7-nitro-1-octylquinolin-2-one Traditional Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-(2-methylpentoxy)-7-nitro-1-octyl-carbostyril Formula: C33H50N2O5 MolecularWeight: 554.7605

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC(C)CCC)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC(C)CCC)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C33H50N2O5/c1-7-9-10-11-12-13-21-34-30-23-28(35(37)38)18-19-29(30)31(32(33(34)36)40-24-27(6)15-8-2)39-22-20-26(5)17-14-16-25(3)4/h16,18-20,23,27H,7-15,17,21-22,24H2,1-6H3/b26-20+