ethyl 4-[[5-bromanyl-1,6-diethyl-2-(methoxymethyl)-4-oxidanylidene-pyridin-3-yl]carbonylamino]-3,5-diethyl-benzoate

Systemtic Name: ethyl 4-[[5-bromanyl-1,6-diethyl-2-(methoxymethyl)-4-oxidanylidene-pyridin-3-yl]carbonylamino]-3,5-diethyl-benzoate Openeye Name: ethyl 4-[[5-bromo-1,6-diethyl-2-(methoxymethyl)-4-oxo-pyridine-3-carbonyl]amino]-3,5-diethyl-benzoate CAS Name: 4-[[[5-bromo-1,6-diethyl-2-(methoxymethyl)-4-oxo-3-pyridinyl]-oxomethyl]amino]-3,5-diethylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-bromo-1,6-diethyl-2-(methoxymethyl)-4-oxopyridine-3-carbonyl]amino]-3,5-diethylbenzoate Traditional Name: 4-[[5-bromo-1,6-diethyl-4-keto-2-(methoxymethyl)nicotinoyl]amino]-3,5-diethyl-benzoic acid ethyl ester Formula: C25H33BrN2O5 MolecularWeight: 521.44392

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1NC(=O)C2=C(N(C(=C(C2=O)Br)CC)CC)COC)CC)C(=O)OCC

Isomeric SMILES

CCC1=CC(=CC(=C1NC(=O)C2=C(N(C(=C(C2=O)Br)CC)CC)COC)CC)C(=O)OCC

InChI

InChI=1S/C25H33BrN2O5/c1-7-15-12-17(25(31)33-11-5)13-16(8-2)22(15)27-24(30)20-19(14-32-6)28(10-4)18(9-3)21(26)23(20)29/h12-13H,7-11,14H2,1-6H3,(H,27,30)