4-[2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]ethanoylamino]butanoic acid

Systemtic Name: 4-[2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]ethanoylamino]butanoic acid Openeye Name: 4-[[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]acetyl]amino]butanoic acid CAS Name: 4-[[2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]-1-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]acetyl]amino]butanoic acid Traditional Name: 4-[[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]acetyl]amino]butyric acid Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NCCCC(=O)O)OC2=CN=C3C=C(C=CC3=N2)Cl

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NCCCC(=O)O)OC2=CN=C3C=C(C=CC3=N2)Cl

InChI

InChI=1S/C20H18ClN3O5/c21-13-3-8-16-17(10-13)23-11-19(24-16)29-15-6-4-14(5-7-15)28-12-18(25)22-9-1-2-20(26)27/h3-8,10-11H,1-2,9,12H2,(H,22,25)(H,26,27)