1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-3-oxidanyl-quinolin-2-one

Systemtic Name: 1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-7-nitro-3-oxidanyl-quinolin-2-one Openeye Name: 1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-7-nitro-quinolin-2-one CAS Name: 1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-7-nitro-2-quinolinone IUPAC Name: 1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-7-nitroquinolin-2-one Traditional Name: 1-butyl-4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-3-hydroxy-7-nitro-carbostyril Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)O)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCCN1C2=C(C=CC(=C2)[N+](=O)[O-])C(=C(C1=O)O)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C23H30N2O5/c1-5-6-13-24-20-15-18(25(28)29)10-11-19(20)22(21(26)23(24)27)30-14-12-17(4)9-7-8-16(2)3/h8,10-12,15,26H,5-7,9,13-14H2,1-4H3/b17-12+