4-[4-methoxy-1-(phenylsulfonyl)pyrrol-2-yl]-4-oxidanylidene-butanal

Systemtic Name: 4-[4-methoxy-1-(phenylsulfonyl)pyrrol-2-yl]-4-oxidanylidene-butanal Openeye Name: 4-[1-(benzenesulfonyl)-4-methoxy-pyrrol-2-yl]-4-oxo-butanal CAS Name: 4-[1-(benzenesulfonyl)-4-methoxy-2-pyrrolyl]-4-oxobutanal IUPAC Name: 4-[1-(benzenesulfonyl)-4-methoxypyrrol-2-yl]-4-oxobutanal Traditional Name: 4-(1-besyl-4-methoxy-pyrrol-2-yl)-4-keto-butyraldehyde Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=C1)C(=O)CCC=O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CN(C(=C1)C(=O)CCC=O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H15NO5S/c1-21-12-10-14(15(18)8-5-9-17)16(11-12)22(19,20)13-6-3-2-4-7-13/h2-4,6-7,9-11H,5,8H2,1H3