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4-butyl-7-[(2-methoxy-5-nitro-phenyl)methoxy]chromen-2-one

4-butyl-7-[(2-methoxy-5-nitro-phenyl)methoxy]chromen-2-one

Systemtic Name:4-butyl-7-[(2-methoxy-5-nitro-phenyl)methoxy]chromen-2-one
Openeye Name:4-butyl-7-[(2-methoxy-5-nitro-phenyl)methoxy]chromen-2-one
CAS Name:4-butyl-7-[(2-methoxy-5-nitrophenyl)methoxy]-1-benzopyran-2-one
IUPAC Name:4-butyl-7-[(2-methoxy-5-nitrophenyl)methoxy]chromen-2-one
Traditional Name:4-butyl-7-(2-methoxy-5-nitro-benzyl)oxy-coumarin
Formula: C21H21NO6
MolecularWeight: 383.39454
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=C(C=CC(=C3)[N+](=O)[O-])OC


Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=C(C=CC(=C3)[N+](=O)[O-])OC


InChI

InChI=1S/C21H21NO6/c1-3-4-5-14-11-21(23)28-20-12-17(7-8-18(14)20)27-13-15-10-16(22(24)25)6-9-19(15)26-2/h6-12H,3-5,13H2,1-2H3


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