2-[2-(3-chlorophenyl)-1-oxidanylidene-3-quinoxalin-6-yl-4-oxaspiro[4.5]dec-2-en-8-yl]ethanoic acid

Systemtic Name: 2-[2-(3-chlorophenyl)-1-oxidanylidene-3-quinoxalin-6-yl-4-oxaspiro[4.5]dec-2-en-8-yl]ethanoic acid Openeye Name: 2-[2-(3-chlorophenyl)-1-oxo-3-quinoxalin-6-yl-4-oxaspiro[4.5]dec-2-en-8-yl]acetic acid CAS Name: 2-[2-(3-chlorophenyl)-1-oxo-3-(6-quinoxalinyl)-4-oxaspiro[4.5]dec-2-en-8-yl]acetic acid IUPAC Name: 2-[2-(3-chlorophenyl)-1-oxo-3-quinoxalin-6-yl-4-oxaspiro[4.5]dec-2-en-8-yl]acetic acid Traditional Name: 2-[2-(3-chlorophenyl)-1-keto-3-quinoxalin-6-yl-4-oxaspiro[4.5]dec-2-en-8-yl]acetic acid Formula: C25H21ClN2O4 MolecularWeight: 448.89824

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCC1CC(=O)O)C(=O)C(=C(O2)C3=CC4=NC=CN=C4C=C3)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CC2(CCC1CC(=O)O)C(=O)C(=C(O2)C3=CC4=NC=CN=C4C=C3)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C25H21ClN2O4/c26-18-3-1-2-16(13-18)22-23(17-4-5-19-20(14-17)28-11-10-27-19)32-25(24(22)31)8-6-15(7-9-25)12-21(29)30/h1-5,10-11,13-15H,6-9,12H2,(H,29,30)