5-[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]pentanoic acid

Systemtic Name: 5-[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]pentanoic acid Openeye Name: 5-[2-oxo-1-phenyl-3-(4-pyridylmethyl)indolin-3-yl]pentanoic acid CAS Name: 5-[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)-3-indolyl]pentanoic acid IUPAC Name: 5-[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]pentanoic acid Traditional Name: 5-[2-keto-1-phenyl-3-(4-pyridylmethyl)indolin-3-yl]valeric acid Formula: C25H24N2O3 MolecularWeight: 400.46966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N2O3/c28-23(29)12-6-7-15-25(18-19-13-16-26-17-14-19)21-10-4-5-11-22(21)27(24(25)30)20-8-2-1-3-9-20/h1-5,8-11,13-14,16-17H,6-7,12,15,18H2,(H,28,29)