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

Systemtic Name: 4-butoxy-1-ethyl-3-(2-methylpentoxy)-7-nitro-quinolin-2-one Openeye Name: 4-butoxy-1-ethyl-3-(2-methylpentoxy)-7-nitro-quinolin-2-one CAS Name: 4-butoxy-1-ethyl-3-(2-methylpentoxy)-7-nitro-2-quinolinone IUPAC Name: 4-butoxy-1-ethyl-3-(2-methylpentoxy)-7-nitroquinolin-2-one Traditional Name: 4-butoxy-1-ethyl-3-(2-methylpentoxy)-7-nitro-carbostyril Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])CC)OCC(C)CCC

Isomeric SMILES

CCCCOC1=C(C(=O)N(C2=C1C=CC(=C2)[N+](=O)[O-])CC)OCC(C)CCC

InChI

InChI=1S/C21H30N2O5/c1-5-8-12-27-19-17-11-10-16(23(25)26)13-18(17)22(7-3)21(24)20(19)28-14-15(4)9-6-2/h10-11,13,15H,5-9,12,14H2,1-4H3