4-[(pyridin-4-ylcarbonylamino)methyl]benzoate

Systemtic Name: 4-[(pyridin-4-ylcarbonylamino)methyl]benzoate Openeye Name: 4-[(pyridine-4-carbonylamino)methyl]benzoate CAS Name: 4-[[[oxo(pyridin-4-yl)methyl]amino]methyl]benzoate IUPAC Name: 4-[(pyridine-4-carbonylamino)methyl]benzoate Traditional Name: 4-(isonicotinamidomethyl)benzoate Formula: C14H11N2O3- MolecularWeight: 255.24874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=NC=C2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=NC=C2)C(=O)[O-]

InChI

InChI=1S/C14H12N2O3/c17-13(11-5-7-15-8-6-11)16-9-10-1-3-12(4-2-10)14(18)19/h1-8H,9H2,(H,16,17)(H,18,19)/p-1