3-butoxy-1-butyl-7-nitro-2-oxidanyl-quinolin-4-one

Systemtic Name: 3-butoxy-1-butyl-7-nitro-2-oxidanyl-quinolin-4-one Openeye Name: 3-butoxy-1-butyl-2-hydroxy-7-nitro-quinolin-4-one CAS Name: 3-butoxy-1-butyl-2-hydroxy-7-nitro-4-quinolinone IUPAC Name: 3-butoxy-1-butyl-2-hydroxy-7-nitroquinolin-4-one Traditional Name: 3-butoxy-1-butyl-2-hydroxy-7-nitro-4-quinolone Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCCCC

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=O)C(=C1O)OCCCC

InChI

InChI=1S/C17H22N2O5/c1-3-5-9-18-14-11-12(19(22)23)7-8-13(14)15(20)16(17(18)21)24-10-6-4-2/h7-8,11,21H,3-6,9-10H2,1-2H3