(1-azanyloxy-3-methyl-but-2-en-2-yl) 3-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]propanoate

Systemtic Name: (1-azanyloxy-3-methyl-but-2-en-2-yl) 3-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]propanoate Openeye Name: [1-(aminooxymethyl)-2-methyl-prop-1-enyl] 3-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate CAS Name: 3-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]propanoic acid (1-aminooxy-3-methylbut-2-en-2-yl) ester IUPAC Name: (1-aminooxy-3-methylbut-2-en-2-yl) 3-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoate Traditional Name: 3-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propionic acid [1-(aminooxymethyl)-2-methyl-prop-1-enyl] ester Formula: C22H22ClN3O5 MolecularWeight: 443.88018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CON)OC(=O)CCOC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl)C

Isomeric SMILES

CC(=C(CON)OC(=O)CCOC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl)C

InChI

InChI=1S/C22H22ClN3O5/c1-14(2)20(13-29-24)31-22(27)9-10-28-16-4-6-17(7-5-16)30-21-12-25-19-11-15(23)3-8-18(19)26-21/h3-8,11-12H,9-10,13,24H2,1-2H3