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

Systemtic Name: 3-[7-chloranyl-4-(2-methylpropyl)-3-oxidanylidene-quinoxalin-2-yl]propanoic acid Openeye Name: 3-(7-chloro-4-isobutyl-3-oxo-quinoxalin-2-yl)propanoic acid CAS Name: 3-[7-chloro-4-(2-methylpropyl)-3-oxo-2-quinoxalinyl]propanoic acid IUPAC Name: 3-[7-chloro-4-(2-methylpropyl)-3-oxoquinoxalin-2-yl]propanoic acid Traditional Name: 3-(7-chloro-4-isobutyl-3-keto-quinoxalin-2-yl)propionic acid Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C=C(C=C2)Cl)N=C(C1=O)CCC(=O)O

Isomeric SMILES

CC(C)CN1C2=C(C=C(C=C2)Cl)N=C(C1=O)CCC(=O)O

InChI

InChI=1S/C15H17ClN2O3/c1-9(2)8-18-13-5-3-10(16)7-12(13)17-11(15(18)21)4-6-14(19)20/h3,5,7,9H,4,6,8H2,1-2H3,(H,19,20)