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

Systemtic Name: 2-[2-[4-(6-chloranylquinoxalin-2-yl)oxyphenoxy]ethanoylamino]butanedioic acid Openeye Name: 2-[[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]acetyl]amino]butanedioic acid CAS Name: 2-[[2-[4-[(6-chloro-2-quinoxalinyl)oxy]phenoxy]-1-oxoethyl]amino]butanedioic acid IUPAC Name: 2-[[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]acetyl]amino]butanedioic acid Traditional Name: 2-[[2-[4-(6-chloroquinoxalin-2-yl)oxyphenoxy]acetyl]amino]succinic acid Formula: C20H16ClN3O7 MolecularWeight: 445.80994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN3O7/c21-11-1-6-14-15(7-11)22-9-18(24-14)31-13-4-2-12(3-5-13)30-10-17(25)23-16(20(28)29)8-19(26)27/h1-7,9,16H,8,10H2,(H,23,25)(H,26,27)(H,28,29)