4-[(5S)-3-(6-methyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-phenyl-pyrazolidin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(5S)-3-(6-methyl-2-oxidanylidene-4-phenyl-quinolin-3-ylidene)-5-phenyl-pyrazolidin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(5S)-3-(6-methyl-2-oxo-4-phenyl-3-quinolylidene)-5-phenyl-pyrazolidin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[(5S)-3-(6-methyl-2-oxo-4-phenyl-3-quinolinylidene)-5-phenyl-1-pyrazolidinyl]-4-oxobutanoic acid IUPAC Name: 4-[(5S)-3-(6-methyl-2-oxo-4-phenylquinolin-3-ylidene)-5-phenylpyrazolidin-1-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[(5S)-3-(2-keto-6-methyl-4-phenyl-3-quinolylidene)-5-phenyl-pyrazolidin-1-yl]butyric acid Formula: C29H25N3O4 MolecularWeight: 479.5265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C3CC(N(N3)C(=O)CCC(=O)O)C4=CC=CC=C4)C(=O)N=C2C=C1)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C(=C3C[C@H](N(N3)C(=O)CCC(=O)O)C4=CC=CC=C4)C(=O)N=C2C=C1)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3O4/c1-18-12-13-22-21(16-18)27(20-10-6-3-7-11-20)28(29(36)30-22)23-17-24(19-8-4-2-5-9-19)32(31-23)25(33)14-15-26(34)35/h2-13,16,24,31H,14-15,17H2,1H3,(H,34,35)/t24-/m0/s1