2-[2-(3-oxidanylidenepentan-2-yl)pyrrol-1-yl]ethyl ethanoate

Systemtic Name: 2-[2-(3-oxidanylidenepentan-2-yl)pyrrol-1-yl]ethyl ethanoate Openeye Name: 2-[2-(1-methyl-2-oxo-butyl)pyrrol-1-yl]ethyl acetate CAS Name: acetic acid 2-[2-(3-oxopentan-2-yl)-1-pyrrolyl]ethyl ester IUPAC Name: 2-[2-(3-oxopentan-2-yl)pyrrol-1-yl]ethyl acetate Traditional Name: acetic acid 2-[2-(2-keto-1-methyl-butyl)pyrrol-1-yl]ethyl ester Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO3/c1-4-13(16)10(2)12-6-5-7-14(12)8-9-17-11(3)15/h5-7,10H,4,8-9H2,1-3H3