2-[phenyl(pyridin-4-ylcarbonyl)amino]ethyl 3-bromanylbenzoate

Systemtic Name: 2-[phenyl(pyridin-4-ylcarbonyl)amino]ethyl 3-bromanylbenzoate Openeye Name: 2-[N-(pyridine-4-carbonyl)anilino]ethyl 3-bromobenzoate CAS Name: 3-bromobenzoic acid 2-(N-[oxo(pyridin-4-yl)methyl]anilino)ethyl ester IUPAC Name: 2-[N-(pyridine-4-carbonyl)anilino]ethyl 3-bromobenzoate Traditional Name: 3-bromobenzoic acid 2-(N-isonicotinoylanilino)ethyl ester Formula: C21H17BrN2O3 MolecularWeight: 425.27528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCOC(=O)C2=CC(=CC=C2)Br)C(=O)C3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)N(CCOC(=O)C2=CC(=CC=C2)Br)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C21H17BrN2O3/c22-18-6-4-5-17(15-18)21(26)27-14-13-24(19-7-2-1-3-8-19)20(25)16-9-11-23-12-10-16/h1-12,15H,13-14H2