ethyl 3-[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]propanoate chloride

Systemtic Name: ethyl 3-[2-oxidanylidene-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]propanoate chloride Openeye Name: ethyl 3-[2-oxo-1-phenyl-3-(4-pyridylmethyl)indolin-3-yl]propanoate chloride CAS Name: 3-[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)-3-indolyl]propanoic acid ethyl ester chloride IUPAC Name: ethyl 3-[2-oxo-1-phenyl-3-(pyridin-4-ylmethyl)indol-3-yl]propanoate chloride Traditional Name: 3-[2-keto-1-phenyl-3-(4-pyridylmethyl)indolin-3-yl]propionic acid ethyl ester chloride Formula: C25H24ClN2O3- MolecularWeight: 435.92266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1(C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)CC4=CC=NC=C4.[Cl-]

Isomeric SMILES

CCOC(=O)CCC1(C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)CC4=CC=NC=C4.[Cl-]

InChI

InChI=1S/C25H24N2O3.ClH/c1-2-30-23(28)12-15-25(18-19-13-16-26-17-14-19)21-10-6-7-11-22(21)27(24(25)29)20-8-4-3-5-9-20;/h3-11,13-14,16-17H,2,12,15,18H2,1H3;1H/p-1