methyl 2-[[6-[3-bromanylpropyl(methyl)carbamoyl]pyridin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[6-[3-bromanylpropyl(methyl)carbamoyl]pyridin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[6-[3-bromopropyl(methyl)carbamoyl]pyridine-3-carbonyl]amino]benzoate CAS Name: 2-[[[6-[[3-bromopropyl(methyl)amino]-oxomethyl]-3-pyridinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[6-[3-bromopropyl(methyl)carbamoyl]pyridine-3-carbonyl]amino]benzoate Traditional Name: 2-[[6-[3-bromopropyl(methyl)carbamoyl]nicotinoyl]amino]benzoic acid methyl ester Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCBr)C(=O)C1=NC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CN(CCCBr)C(=O)C1=NC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C19H20BrN3O4/c1-23(11-5-10-20)18(25)16-9-8-13(12-21-16)17(24)22-15-7-4-3-6-14(15)19(26)27-2/h3-4,6-9,12H,5,10-11H2,1-2H3,(H,22,24)