1-hexyl-7-nitro-2-oxidanyl-3-prop-2-enoxy-quinolin-4-one

Systemtic Name: 1-hexyl-7-nitro-2-oxidanyl-3-prop-2-enoxy-quinolin-4-one Openeye Name: 3-allyloxy-1-hexyl-2-hydroxy-7-nitro-quinolin-4-one CAS Name: 1-hexyl-2-hydroxy-7-nitro-3-prop-2-enoxy-4-quinolinone IUPAC Name: 1-hexyl-2-hydroxy-7-nitro-3-prop-2-enoxyquinolin-4-one Traditional Name: 3-allyloxy-1-hexyl-2-hydroxy-7-nitro-4-quinolone Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCC=C

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCC=C

InChI

InChI=1S/C18H22N2O5/c1-3-5-6-7-10-19-15-12-13(20(23)24)8-9-14(15)16(21)17(18(19)22)25-11-4-2/h4,8-9,12,22H,2-3,5-7,10-11H2,1H3