[2-[2-(7-chloranylquinoxalin-2-yl)oxyphenoxy]propanoylamino] ethanesulfonate

Systemtic Name: [2-[2-(7-chloranylquinoxalin-2-yl)oxyphenoxy]propanoylamino] ethanesulfonate Openeye Name: [2-[2-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanoylamino] ethanesulfonate CAS Name: ethanesulfonic acid [[2-[2-[(7-chloro-2-quinoxalinyl)oxy]phenoxy]-1-oxopropyl]amino] ester IUPAC Name: [2-[2-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanoylamino] ethanesulfonate Traditional Name: ethanesulfonic acid [2-[2-(7-chloroquinoxalin-2-yl)oxyphenoxy]propanoylamino] ester Formula: C19H18ClN3O6S MolecularWeight: 451.88072

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)ONC(=O)C(C)OC1=CC=CC=C1OC2=CN=C3C=CC(=CC3=N2)Cl

Isomeric SMILES

CCS(=O)(=O)ONC(=O)C(C)OC1=CC=CC=C1OC2=CN=C3C=CC(=CC3=N2)Cl

InChI

InChI=1S/C19H18ClN3O6S/c1-3-30(25,26)29-23-19(24)12(2)27-16-6-4-5-7-17(16)28-18-11-21-14-9-8-13(20)10-15(14)22-18/h4-12H,3H2,1-2H3,(H,23,24)