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

Systemtic Name: ethyl 4-[(5-bromanyl-2-butyl-1,6-dimethyl-4-oxidanylidene-pyridin-3-yl)carbonylamino]-3,5-diethyl-benzoate Openeye Name: ethyl 4-[(5-bromo-2-butyl-1,6-dimethyl-4-oxo-pyridine-3-carbonyl)amino]-3,5-diethyl-benzoate CAS Name: 4-[[(5-bromo-2-butyl-1,6-dimethyl-4-oxo-3-pyridinyl)-oxomethyl]amino]-3,5-diethylbenzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-bromo-2-butyl-1,6-dimethyl-4-oxopyridine-3-carbonyl)amino]-3,5-diethylbenzoate Traditional Name: 4-[(5-bromo-2-butyl-4-keto-1,6-dimethyl-nicotinoyl)amino]-3,5-diethyl-benzoic acid ethyl ester Formula: C25H33BrN2O4 MolecularWeight: 505.44452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C(=C(N1C)C)Br)C(=O)NC2=C(C=C(C=C2CC)C(=O)OCC)CC

Isomeric SMILES

CCCCC1=C(C(=O)C(=C(N1C)C)Br)C(=O)NC2=C(C=C(C=C2CC)C(=O)OCC)CC

InChI

InChI=1S/C25H33BrN2O4/c1-7-11-12-19-20(23(29)21(26)15(5)28(19)6)24(30)27-22-16(8-2)13-18(14-17(22)9-3)25(31)32-10-4/h13-14H,7-12H2,1-6H3,(H,27,30)