3-[3-(dioxidanyl)-3-methoxy-prop-1-en-2-yl]-1-(phenylsulfonyl)indole

Systemtic Name: 3-[3-(dioxidanyl)-3-methoxy-prop-1-en-2-yl]-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-3-[1-[hydroperoxy(methoxy)methyl]vinyl]indole CAS Name: 1-(benzenesulfonyl)-3-(3-hydroperoxy-3-methoxyprop-1-en-2-yl)indole IUPAC Name: 1-(benzenesulfonyl)-3-(3-hydroperoxy-3-methoxyprop-1-en-2-yl)indole Traditional Name: 1-besyl-3-[1-[hydroperoxy(methoxy)methyl]vinyl]indole Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=C)C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)OO

Isomeric SMILES

COC(C(=C)C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)OO

InChI

InChI=1S/C18H17NO5S/c1-13(18(23-2)24-20)16-12-19(17-11-7-6-10-15(16)17)25(21,22)14-8-4-3-5-9-14/h3-12,18,20H,1H2,2H3