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

Systemtic Name: 4-butoxy-1-butyl-3-(2-methylpentoxy)-7-nitro-quinolin-2-one Openeye Name: 4-butoxy-1-butyl-3-(2-methylpentoxy)-7-nitro-quinolin-2-one CAS Name: 4-butoxy-1-butyl-3-(2-methylpentoxy)-7-nitro-2-quinolinone IUPAC Name: 4-butoxy-1-butyl-3-(2-methylpentoxy)-7-nitroquinolin-2-one Traditional Name: 4-butoxy-1-butyl-3-(2-methylpentoxy)-7-nitro-carbostyril Formula: C23H34N2O5 MolecularWeight: 418.52646

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)OCCCC

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O5/c1-5-8-13-24-20-15-18(25(27)28)11-12-19(20)21(29-14-9-6-2)22(23(24)26)30-16-17(4)10-7-3/h11-12,15,17H,5-10,13-14,16H2,1-4H3