ethyl 2-[(6-bromanylpyridin-3-yl)methyl-(3-oxidanylidene-2-propyl-heptanoyl)amino]-3-methyl-butanoate

Systemtic Name: ethyl 2-[(6-bromanylpyridin-3-yl)methyl-(3-oxidanylidene-2-propyl-heptanoyl)amino]-3-methyl-butanoate Openeye Name: ethyl 2-[(6-bromo-3-pyridyl)methyl-(3-oxo-2-propyl-heptanoyl)amino]-3-methyl-butanoate CAS Name: 2-[(6-bromo-3-pyridinyl)methyl-(1,3-dioxo-2-propylheptyl)amino]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[(6-bromopyridin-3-yl)methyl-(3-oxo-2-propylheptanoyl)amino]-3-methylbutanoate Traditional Name: 2-[(6-bromo-3-pyridyl)methyl-(3-keto-2-propyl-heptanoyl)amino]-3-methyl-butyric acid ethyl ester Formula: C23H35BrN2O4 MolecularWeight: 483.439

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(CCC)C(=O)N(CC1=CN=C(C=C1)Br)C(C(C)C)C(=O)OCC

Isomeric SMILES

CCCCC(=O)C(CCC)C(=O)N(CC1=CN=C(C=C1)Br)C(C(C)C)C(=O)OCC

InChI

InChI=1S/C23H35BrN2O4/c1-6-9-11-19(27)18(10-7-2)22(28)26(15-17-12-13-20(24)25-14-17)21(16(4)5)23(29)30-8-3/h12-14,16,18,21H,6-11,15H2,1-5H3