3-[2-(5-chloranyl-1H-indol-3-yl)ethylcarbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[2-(5-chloranyl-1H-indol-3-yl)ethylcarbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylcarbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[2-(5-chloro-1H-indol-3-yl)ethylamino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylcarbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[2-(5-chloro-1H-indol-3-yl)ethylcarbamoyl]pyrazinoic acid Formula: C16H13ClN4O3 MolecularWeight: 344.75242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=CN2)CCNC(=O)C3=NC=CN=C3C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=CN2)CCNC(=O)C3=NC=CN=C3C(=O)O

InChI

InChI=1S/C16H13ClN4O3/c17-10-1-2-12-11(7-10)9(8-21-12)3-4-20-15(22)13-14(16(23)24)19-6-5-18-13/h1-2,5-8,21H,3-4H2,(H,20,22)(H,23,24)