1-butyl-4-methoxy-3-(2-methylpentoxy)-7-nitro-quinolin-2-one

Systemtic Name: 1-butyl-4-methoxy-3-(2-methylpentoxy)-7-nitro-quinolin-2-one Openeye Name: 1-butyl-4-methoxy-3-(2-methylpentoxy)-7-nitro-quinolin-2-one CAS Name: 1-butyl-4-methoxy-3-(2-methylpentoxy)-7-nitro-2-quinolinone IUPAC Name: 1-butyl-4-methoxy-3-(2-methylpentoxy)-7-nitroquinolin-2-one Traditional Name: 1-butyl-4-methoxy-3-(2-methylpentoxy)-7-nitro-carbostyril Formula: C20H28N2O5 MolecularWeight: 376.44672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC(C)CCC)OC

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCC(C)CCC)OC

InChI

InChI=1S/C20H28N2O5/c1-5-7-11-21-17-12-15(22(24)25)9-10-16(17)18(26-4)19(20(21)23)27-13-14(3)8-6-2/h9-10,12,14H,5-8,11,13H2,1-4H3