2-[2-(4-bromanyl-3-oxidanylidene-pentan-2-yl)pyrrol-1-yl]ethyl ethanoate

Systemtic Name: 2-[2-(4-bromanyl-3-oxidanylidene-pentan-2-yl)pyrrol-1-yl]ethyl ethanoate Openeye Name: 2-[2-(3-bromo-1-methyl-2-oxo-butyl)pyrrol-1-yl]ethyl acetate CAS Name: acetic acid 2-[2-(4-bromo-3-oxopentan-2-yl)-1-pyrrolyl]ethyl ester IUPAC Name: 2-[2-(4-bromo-3-oxopentan-2-yl)pyrrol-1-yl]ethyl acetate Traditional Name: acetic acid 2-[2-(3-bromo-2-keto-1-methyl-butyl)pyrrol-1-yl]ethyl ester Formula: C13H18BrNO3 MolecularWeight: 316.19092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CN1CCOC(=O)C)C(=O)C(C)Br

Isomeric SMILES

CC(C1=CC=CN1CCOC(=O)C)C(=O)C(C)Br

InChI

InChI=1S/C13H18BrNO3/c1-9(13(17)10(2)14)12-5-4-6-15(12)7-8-18-11(3)16/h4-6,9-10H,7-8H2,1-3H3