3-[4-[(6-fluoranyl-1H-indol-3-yl)methyl]-2-[(4-naphthalen-2-yloxan-4-yl)carbamoyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[(6-fluoranyl-1H-indol-3-yl)methyl]-2-[(4-naphthalen-2-yloxan-4-yl)carbamoyl]phenyl]propanoic acid Openeye Name: 3-[4-[(6-fluoro-1H-indol-3-yl)methyl]-2-[[4-(2-naphthyl)tetrahydropyran-4-yl]carbamoyl]phenyl]propanoic acid CAS Name: 3-[4-[(6-fluoro-1H-indol-3-yl)methyl]-2-[[[4-(2-naphthalenyl)-4-oxanyl]amino]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[(6-fluoro-1H-indol-3-yl)methyl]-2-[(4-naphthalen-2-yloxan-4-yl)carbamoyl]phenyl]propanoic acid Traditional Name: 3-[4-[(6-fluoro-1H-indol-3-yl)methyl]-2-[[4-(2-naphthyl)tetrahydropyran-4-yl]carbamoyl]phenyl]propionic acid Formula: C34H31FN2O4 MolecularWeight: 550.619343

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC3=CC=CC=C3C=C2)NC(=O)C4=C(C=CC(=C4)CC5=CNC6=C5C=CC(=C6)F)CCC(=O)O

Isomeric SMILES

C1COCCC1(C2=CC3=CC=CC=C3C=C2)NC(=O)C4=C(C=CC(=C4)CC5=CNC6=C5C=CC(=C6)F)CCC(=O)O

InChI

InChI=1S/C34H31FN2O4/c35-28-10-11-29-26(21-36-31(29)20-28)17-22-5-6-24(8-12-32(38)39)30(18-22)33(40)37-34(13-15-41-16-14-34)27-9-7-23-3-1-2-4-25(23)19-27/h1-7,9-11,18-21,36H,8,12-17H2,(H,37,40)(H,38,39)