[3-(1,3-dioxan-2-yl)-1-oxidanylidene-1-[1-(phenylsulfonyl)pyrrol-3-yl]propan-2-yl] ethanoate

Systemtic Name: [3-(1,3-dioxan-2-yl)-1-oxidanylidene-1-[1-(phenylsulfonyl)pyrrol-3-yl]propan-2-yl] ethanoate Openeye Name: [2-[1-(benzenesulfonyl)pyrrol-3-yl]-1-(1,3-dioxan-2-ylmethyl)-2-oxo-ethyl] acetate CAS Name: acetic acid [1-[1-(benzenesulfonyl)-3-pyrrolyl]-3-(1,3-dioxan-2-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-[1-(benzenesulfonyl)pyrrol-3-yl]-3-(1,3-dioxan-2-yl)-1-oxopropan-2-yl] acetate Traditional Name: acetic acid [2-(1-besylpyrrol-3-yl)-1-(1,3-dioxan-2-ylmethyl)-2-keto-ethyl] ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1OCCCO1)C(=O)C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OC(CC1OCCCO1)C(=O)C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21NO7S/c1-14(21)27-17(12-18-25-10-5-11-26-18)19(22)15-8-9-20(13-15)28(23,24)16-6-3-2-4-7-16/h2-4,6-9,13,17-18H,5,10-12H2,1H3