3-[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]propanoic acid

Systemtic Name: 3-[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]propanoic acid Openeye Name: 3-[2-oxo-1-phenyl-3-(4-pyridylmethyl)indolin-3-yl]propanoic acid CAS Name: 3-[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)-3-indolyl]propanoic acid IUPAC Name: 3-[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]propanoic acid Traditional Name: 3-[2-keto-1-phenyl-3-(4-pyridylmethyl)indolin-3-yl]propionic acid Formula: C23H20N2O3 MolecularWeight: 372.4165

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=CC=CC=C3C(C2=O)(CCC(=O)O)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=CC=CC=C3C(C2=O)(CCC(=O)O)CC4=CC=NC=C4

InChI

InChI=1S/C23H20N2O3/c26-21(27)10-13-23(16-17-11-14-24-15-12-17)19-8-4-5-9-20(19)25(22(23)28)18-6-2-1-3-7-18/h1-9,11-12,14-15H,10,13,16H2,(H,26,27)