3-[(2-chloranyl-6-phenoxy-phenyl)methylcarbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(2-chloranyl-6-phenoxy-phenyl)methylcarbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(2-chloro-6-phenoxy-phenyl)methylcarbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[(2-chloro-6-phenoxyphenyl)methylamino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(2-chloro-6-phenoxyphenyl)methylcarbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(2-chloro-6-phenoxy-benzyl)carbamoyl]pyrazinoic acid Formula: C19H14ClN3O4 MolecularWeight: 383.78516

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)CNC(=O)C3=NC=CN=C3C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C(=CC=C2)Cl)CNC(=O)C3=NC=CN=C3C(=O)O

InChI

InChI=1S/C19H14ClN3O4/c20-14-7-4-8-15(27-12-5-2-1-3-6-12)13(14)11-23-18(24)16-17(19(25)26)22-10-9-21-16/h1-10H,11H2,(H,23,24)(H,25,26)