2-[3-chloranyl-4-(quinoxalin-6-ylcarbonylcarbamoylamino)phenoxy]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-(quinoxalin-6-ylcarbonylcarbamoylamino)phenoxy]ethanoic acid Openeye Name: 2-[3-chloro-4-(quinoxaline-6-carbonylcarbamoylamino)phenoxy]acetic acid CAS Name: 2-[3-chloro-4-[[oxo-[[oxo(6-quinoxalinyl)methyl]amino]methyl]amino]phenoxy]acetic acid IUPAC Name: 2-[3-chloro-4-(quinoxaline-6-carbonylcarbamoylamino)phenoxy]acetic acid Traditional Name: 2-[3-chloro-4-(quinoxaline-6-carbonylcarbamoylamino)phenoxy]acetic acid Formula: C18H13ClN4O5 MolecularWeight: 400.77262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=CN=C2C=C1C(=O)NC(=O)NC3=C(C=C(C=C3)OCC(=O)O)Cl

Isomeric SMILES

C1=CC2=NC=CN=C2C=C1C(=O)NC(=O)NC3=C(C=C(C=C3)OCC(=O)O)Cl

InChI

InChI=1S/C18H13ClN4O5/c19-12-8-11(28-9-16(24)25)2-4-13(12)22-18(27)23-17(26)10-1-3-14-15(7-10)21-6-5-20-14/h1-8H,9H2,(H,24,25)(H2,22,23,26,27)