3-[5-(4-propan-2-yloxycarbonylphenyl)furan-2-yl]benzo[f]quinoline-1-carboxylic acid

Systemtic Name: 3-[5-(4-propan-2-yloxycarbonylphenyl)furan-2-yl]benzo[f]quinoline-1-carboxylic acid Openeye Name: 3-[5-(4-isopropoxycarbonylphenyl)-2-furyl]benzo[f]quinoline-1-carboxylic acid CAS Name: 3-[5-[4-[oxo(propan-2-yloxy)methyl]phenyl]-2-furanyl]-1-benzo[f]quinolinecarboxylic acid IUPAC Name: 3-[5-(4-propan-2-yloxycarbonylphenyl)furan-2-yl]benzo[f]quinoline-1-carboxylic acid Traditional Name: 3-[5-(4-isopropoxycarbonylphenyl)-2-furyl]benzo[f]quinoline-1-carboxylic acid Formula: C28H21NO5 MolecularWeight: 451.47004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3=NC4=C(C5=CC=CC=C5C=C4)C(=C3)C(=O)O

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C3=NC4=C(C5=CC=CC=C5C=C4)C(=C3)C(=O)O

InChI

InChI=1S/C28H21NO5/c1-16(2)33-28(32)19-9-7-18(8-10-19)24-13-14-25(34-24)23-15-21(27(30)31)26-20-6-4-3-5-17(20)11-12-22(26)29-23/h3-16H,1-2H3,(H,30,31)