3-[[6-chloranyl-3-oxidanylidene-4-(phenylmethyl)pyrazin-2-yl]amino]propanoic acid

Systemtic Name: 3-[[6-chloranyl-3-oxidanylidene-4-(phenylmethyl)pyrazin-2-yl]amino]propanoic acid Openeye Name: 3-[(4-benzyl-6-chloro-3-oxo-pyrazin-2-yl)amino]propanoic acid CAS Name: 3-[[6-chloro-3-oxo-4-(phenylmethyl)-2-pyrazinyl]amino]propanoic acid IUPAC Name: 3-[(4-benzyl-6-chloro-3-oxopyrazin-2-yl)amino]propanoic acid Traditional Name: 3-[(4-benzyl-6-chloro-3-keto-pyrazin-2-yl)amino]propionic acid Formula: C14H14ClN3O3 MolecularWeight: 307.73226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=C(C2=O)NCCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=C(C2=O)NCCC(=O)O)Cl

InChI

InChI=1S/C14H14ClN3O3/c15-11-9-18(8-10-4-2-1-3-5-10)14(21)13(17-11)16-7-6-12(19)20/h1-5,9H,6-8H2,(H,16,17)(H,19,20)