octyl 4-(pyridin-4-ylcarbonylamino)benzoate

Systemtic Name: octyl 4-(pyridin-4-ylcarbonylamino)benzoate Openeye Name: octyl 4-(pyridine-4-carbonylamino)benzoate CAS Name: 4-[[oxo(pyridin-4-yl)methyl]amino]benzoic acid octyl ester IUPAC Name: octyl 4-(pyridine-4-carbonylamino)benzoate Traditional Name: 4-isonicotinamidobenzoic acid octyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=NC=C2

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C21H26N2O3/c1-2-3-4-5-6-7-16-26-21(25)18-8-10-19(11-9-18)23-20(24)17-12-14-22-15-13-17/h8-15H,2-7,16H2,1H3,(H,23,24)