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

Systemtic Name: 3-[4-(2-methylpropyl)-3-oxidanylidene-quinoxalin-2-yl]propanoic acid Openeye Name: 3-(4-isobutyl-3-oxo-quinoxalin-2-yl)propanoic acid CAS Name: 3-[4-(2-methylpropyl)-3-oxo-2-quinoxalinyl]propanoic acid IUPAC Name: 3-[4-(2-methylpropyl)-3-oxoquinoxalin-2-yl]propanoic acid Traditional Name: 3-(4-isobutyl-3-keto-quinoxalin-2-yl)propionic acid Formula: C15H18N2O3 MolecularWeight: 274.31502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C(C1=O)CCC(=O)O

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C(C1=O)CCC(=O)O

InChI

InChI=1S/C15H18N2O3/c1-10(2)9-17-13-6-4-3-5-11(13)16-12(15(17)20)7-8-14(18)19/h3-6,10H,7-9H2,1-2H3,(H,18,19)