2-[2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]propanoylamino]butanedioic acid

Systemtic Name: 2-[2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]propanoylamino]butanedioic acid Openeye Name: 2-[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoylamino]butanedioic acid CAS Name: 2-[[2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]-1-oxopropyl]amino]butanedioic acid IUPAC Name: 2-[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoylamino]butanedioic acid Traditional Name: 2-[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]propanoylamino]succinic acid Formula: C21H18ClN3O7 MolecularWeight: 459.83652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)O)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C(=O)O)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl

InChI

InChI=1S/C21H18ClN3O7/c1-11(20(28)25-17(21(29)30)9-19(26)27)31-13-3-5-14(6-4-13)32-18-10-23-16-8-12(22)2-7-15(16)24-18/h2-8,10-11,17H,9H2,1H3,(H,25,28)(H,26,27)(H,29,30)