3-[(5-pyridin-4-ylpyridin-2-yl)amino]propyl benzoate

Systemtic Name: 3-[(5-pyridin-4-ylpyridin-2-yl)amino]propyl benzoate Openeye Name: 3-[[5-(4-pyridyl)-2-pyridyl]amino]propyl benzoate CAS Name: benzoic acid 3-[(5-pyridin-4-yl-2-pyridinyl)amino]propyl ester IUPAC Name: 3-[(5-pyridin-4-ylpyridin-2-yl)amino]propyl benzoate Traditional Name: benzoic acid 3-[[5-(4-pyridyl)-2-pyridyl]amino]propyl ester Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCCNC2=NC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCCNC2=NC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C20H19N3O2/c24-20(17-5-2-1-3-6-17)25-14-4-11-22-19-8-7-18(15-23-19)16-9-12-21-13-10-16/h1-3,5-10,12-13,15H,4,11,14H2,(H,22,23)