1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-morpholinosulfonylphenoxy)ethanone CAS Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-[4-(4-morpholinylsulfonyl)phenoxy]ethanone IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-2-(4-morpholin-4-ylsulfonylphenoxy)ethanone Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-morpholinosulfonylphenoxy)ethanone Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)COC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)COC4=CC=C(C=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H26N2O7S/c1-17-13-22(18(2)27(17)19-3-8-24-25(14-19)34-16-33-24)23(28)15-32-20-4-6-21(7-5-20)35(29,30)26-9-11-31-12-10-26/h3-8,13-14H,9-12,15-16H2,1-2H3