1-hexyl-3-methoxy-4-(3-methylbut-2-enoxy)-7-nitro-quinolin-2-one

Systemtic Name: 1-hexyl-3-methoxy-4-(3-methylbut-2-enoxy)-7-nitro-quinolin-2-one Openeye Name: 1-hexyl-3-methoxy-4-(3-methylbut-2-enoxy)-7-nitro-quinolin-2-one CAS Name: 1-hexyl-3-methoxy-4-(3-methylbut-2-enoxy)-7-nitro-2-quinolinone IUPAC Name: 1-hexyl-3-methoxy-4-(3-methylbut-2-enoxy)-7-nitroquinolin-2-one Traditional Name: 1-hexyl-3-methoxy-4-(3-methylbut-2-enoxy)-7-nitro-carbostyril Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC)OCC=C(C)C

Isomeric SMILES

CCCCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)OC)OCC=C(C)C

InChI

InChI=1S/C21H28N2O5/c1-5-6-7-8-12-22-18-14-16(23(25)26)9-10-17(18)19(20(27-4)21(22)24)28-13-11-15(2)3/h9-11,14H,5-8,12-13H2,1-4H3