4-hexoxy-1-methyl-7-nitro-3-oxidanyl-quinolin-2-one

Systemtic Name: 4-hexoxy-1-methyl-7-nitro-3-oxidanyl-quinolin-2-one Openeye Name: 4-hexoxy-3-hydroxy-1-methyl-7-nitro-quinolin-2-one CAS Name: 4-hexoxy-3-hydroxy-1-methyl-7-nitro-2-quinolinone IUPAC Name: 4-hexoxy-3-hydroxy-1-methyl-7-nitroquinolin-2-one Traditional Name: 4-hexoxy-3-hydroxy-1-methyl-7-nitro-carbostyril Formula: C16H20N2O5 MolecularWeight: 320.3404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])C)O

Isomeric SMILES

CCCCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])C)O

InChI

InChI=1S/C16H20N2O5/c1-3-4-5-6-9-23-15-12-8-7-11(18(21)22)10-13(12)17(2)16(20)14(15)19/h7-8,10,19H,3-6,9H2,1-2H3