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ethyl 2-[4-(3-methyl-5-nitro-isoquinolin-1-yl)oxyphenoxy]propanoate

ethyl 2-[4-(3-methyl-5-nitro-isoquinolin-1-yl)oxyphenoxy]propanoate

Systemtic Name:ethyl 2-[4-(3-methyl-5-nitro-isoquinolin-1-yl)oxyphenoxy]propanoate
Openeye Name:ethyl 2-[4-[(3-methyl-5-nitro-1-isoquinolyl)oxy]phenoxy]propanoate
CAS Name:2-[4-[(3-methyl-5-nitro-1-isoquinolinyl)oxy]phenoxy]propanoic acid ethyl ester
IUPAC Name:ethyl 2-[4-(3-methyl-5-nitroisoquinolin-1-yl)oxyphenoxy]propanoate
Traditional Name:2-[4-[(3-methyl-5-nitro-1-isoquinolyl)oxy]phenoxy]propionic acid ethyl ester
Formula: C21H20N2O6
MolecularWeight: 396.3933
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C3C=CC=C(C3=CC(=N2)C)[N+](=O)[O-]


Isomeric SMILES

CCOC(=O)C(C)OC1=CC=C(C=C1)OC2=C3C=CC=C(C3=CC(=N2)C)[N+](=O)[O-]


InChI

InChI=1S/C21H20N2O6/c1-4-27-21(24)14(3)28-15-8-10-16(11-9-15)29-20-17-6-5-7-19(23(25)26)18(17)12-13(2)22-20/h5-12,14H,4H2,1-3H3


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