4-[(5R)-3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-methoxyphenyl)pyrazolidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5R)-3-(6-bromanyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-(4-methoxyphenyl)pyrazolidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(5R)-3-(6-bromo-2-oxo-4-phenyl-3-quinolylidene)-5-(4-methoxyphenyl)pyrazolidin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[(5R)-3-(6-bromo-2-oxo-4-phenyl-3-quinolinylidene)-5-(4-methoxyphenyl)-1-pyrazolidinyl]-4-oxobutanoic acid IUPAC Name: 4-[(5R)-3-(6-bromo-2-oxo-4-phenylquinolin-3-ylidene)-5-(4-methoxyphenyl)pyrazolidin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[(5R)-3-(6-bromo-2-keto-4-phenyl-3-quinolylidene)-5-(4-methoxyphenyl)pyrazolidin-1-yl]-4-keto-butyric acid Formula: C29H24BrN3O5 MolecularWeight: 574.42196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)NN2C(=O)CCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)NN2C(=O)CCC(=O)O

InChI

InChI=1S/C29H24BrN3O5/c1-38-20-10-7-17(8-11-20)24-16-23(32-33(24)25(34)13-14-26(35)36)28-27(18-5-3-2-4-6-18)21-15-19(30)9-12-22(21)31-29(28)37/h2-12,15,24,32H,13-14,16H2,1H3,(H,35,36)/t24-/m1/s1