3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanoic acid

Systemtic Name: 3-[7-chloranyl-3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanoic acid Openeye Name: 3-(4-benzyl-7-chloro-3-oxo-quinoxalin-2-yl)propanoic acid CAS Name: 3-[7-chloro-3-oxo-4-(phenylmethyl)-2-quinoxalinyl]propanoic acid IUPAC Name: 3-(4-benzyl-7-chloro-3-oxoquinoxalin-2-yl)propanoic acid Traditional Name: 3-(4-benzyl-7-chloro-3-keto-quinoxalin-2-yl)propionic acid Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C(C2=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C(C2=O)CCC(=O)O

InChI

InChI=1S/C18H15ClN2O3/c19-13-6-8-16-15(10-13)20-14(7-9-17(22)23)18(24)21(16)11-12-4-2-1-3-5-12/h1-6,8,10H,7,9,11H2,(H,22,23)