2-[2-oxidanylidene-1-piperidin-1-yl-3-(pyridin-4-ylmethyl)indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-1-piperidin-1-yl-3-(pyridin-4-ylmethyl)indol-3-yl]ethanoic acid Openeye Name: 2-[2-oxo-1-(1-piperidyl)-3-(4-pyridylmethyl)indolin-3-yl]acetic acid CAS Name: 2-[2-oxo-1-(1-piperidinyl)-3-(pyridin-4-ylmethyl)-3-indolyl]acetic acid IUPAC Name: 2-[2-oxo-1-piperidin-1-yl-3-(pyridin-4-ylmethyl)indol-3-yl]acetic acid Traditional Name: 2-[2-keto-1-piperidino-3-(4-pyridylmethyl)indolin-3-yl]acetic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)N2C3=CC=CC=C3C(C2=O)(CC4=CC=NC=C4)CC(=O)O

Isomeric SMILES

C1CCN(CC1)N2C3=CC=CC=C3C(C2=O)(CC4=CC=NC=C4)CC(=O)O

InChI

InChI=1S/C21H23N3O3/c25-19(26)15-21(14-16-8-10-22-11-9-16)17-6-2-3-7-18(17)24(20(21)27)23-12-4-1-5-13-23/h2-3,6-11H,1,4-5,12-15H2,(H,25,26)