2-[3-(2,4-dipyridin-4-ylbutyl)-2-oxidanylidene-piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[3-(2,4-dipyridin-4-ylbutyl)-2-oxidanylidene-piperidin-1-yl]ethanoic acid Openeye Name: 2-[3-[2,4-bis(4-pyridyl)butyl]-2-oxo-1-piperidyl]acetic acid CAS Name: 2-[3-(2,4-dipyridin-4-ylbutyl)-2-oxo-1-piperidinyl]acetic acid IUPAC Name: 2-[3-(2,4-dipyridin-4-ylbutyl)-2-oxopiperidin-1-yl]acetic acid Traditional Name: 2-[3-[2,4-bis(4-pyridyl)butyl]-2-keto-piperidino]acetic acid Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC(=O)O)CC(CCC2=CC=NC=C2)C3=CC=NC=C3

Isomeric SMILES

C1CC(C(=O)N(C1)CC(=O)O)CC(CCC2=CC=NC=C2)C3=CC=NC=C3

InChI

InChI=1S/C21H25N3O3/c25-20(26)15-24-13-1-2-19(21(24)27)14-18(17-7-11-23-12-8-17)4-3-16-5-9-22-10-6-16/h5-12,18-19H,1-4,13-15H2,(H,25,26)