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

Systemtic Name: 2-[3-(phenylsulfinyl)pyrrol-1-yl]ethyl ethanoate Openeye Name: 2-[3-(benzenesulfinyl)pyrrol-1-yl]ethyl acetate CAS Name: acetic acid 2-[3-(benzenesulfinyl)-1-pyrrolyl]ethyl ester IUPAC Name: 2-[3-(benzenesulfinyl)pyrrol-1-yl]ethyl acetate Traditional Name: acetic acid 2-[3-(benzenesulfinyl)pyrrol-1-yl]ethyl ester Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN1C=CC(=C1)S(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=O)OCCN1C=CC(=C1)S(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H15NO3S/c1-12(16)18-10-9-15-8-7-14(11-15)19(17)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3