3-butoxy-4-hexoxy-1-hexyl-7-nitro-quinolin-2-one

Systemtic Name: 3-butoxy-4-hexoxy-1-hexyl-7-nitro-quinolin-2-one Openeye Name: 3-butoxy-4-hexoxy-1-hexyl-7-nitro-quinolin-2-one CAS Name: 3-butoxy-4-hexoxy-1-hexyl-7-nitro-2-quinolinone IUPAC Name: 3-butoxy-4-hexoxy-1-hexyl-7-nitroquinolin-2-one Traditional Name: 3-butoxy-4-hexoxy-1-hexyl-7-nitro-carbostyril Formula: C25H38N2O5 MolecularWeight: 446.57962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCCCC)OCCCCCC

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OCCCC)OCCCCCC

InChI

InChI=1S/C25H38N2O5/c1-4-7-10-12-16-26-22-19-20(27(29)30)14-15-21(22)23(31-18-13-11-8-5-2)24(25(26)28)32-17-9-6-3/h14-15,19H,4-13,16-18H2,1-3H3