2-[5-chloranyl-2-oxidanylidene-6-phenyl-3-[(phenylmethyl)amino]pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-2-oxidanylidene-6-phenyl-3-[(phenylmethyl)amino]pyrazin-1-yl]ethanoic acid Openeye Name: 2-[3-(benzylamino)-5-chloro-2-oxo-6-phenyl-pyrazin-1-yl]acetic acid CAS Name: 2-[5-chloro-2-oxo-6-phenyl-3-[(phenylmethyl)amino]-1-pyrazinyl]acetic acid IUPAC Name: 2-[3-(benzylamino)-5-chloro-2-oxo-6-phenylpyrazin-1-yl]acetic acid Traditional Name: 2-[3-(benzylamino)-5-chloro-2-keto-6-phenyl-pyrazin-1-yl]acetic acid Formula: C19H16ClN3O3 MolecularWeight: 369.80164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=C(N(C2=O)CC(=O)O)C3=CC=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=C(N(C2=O)CC(=O)O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C19H16ClN3O3/c20-17-16(14-9-5-2-6-10-14)23(12-15(24)25)19(26)18(22-17)21-11-13-7-3-1-4-8-13/h1-10H,11-12H2,(H,21,22)(H,24,25)