3-butoxy-1-decyl-6-nitro-2-oxidanyl-quinolin-4-one

Systemtic Name: 3-butoxy-1-decyl-6-nitro-2-oxidanyl-quinolin-4-one Openeye Name: 3-butoxy-1-decyl-2-hydroxy-6-nitro-quinolin-4-one CAS Name: 3-butoxy-1-decyl-2-hydroxy-6-nitro-4-quinolinone IUPAC Name: 3-butoxy-1-decyl-2-hydroxy-6-nitroquinolin-4-one Traditional Name: 3-butoxy-1-decyl-2-hydroxy-6-nitro-4-quinolone Formula: C23H34N2O5 MolecularWeight: 418.52646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C(=C1O)OCCCC

Isomeric SMILES

CCCCCCCCCCN1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C(=C1O)OCCCC

InChI

InChI=1S/C23H34N2O5/c1-3-5-7-8-9-10-11-12-15-24-20-14-13-18(25(28)29)17-19(20)21(26)22(23(24)27)30-16-6-4-2/h13-14,17,27H,3-12,15-16H2,1-2H3