4-[1-[4-[3-(dimethylamino)propoxy]phenyl]sulfonylindol-2-yl]-4-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-[4-[3-(dimethylamino)propoxy]phenyl]sulfonylindol-2-yl]-4-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[1-[4-[3-(dimethylamino)propoxy]phenyl]sulfonylindol-2-yl]-4-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[1-[4-[3-(dimethylamino)propoxy]phenyl]sulfonyl-2-indolyl]-4-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-[4-[3-(dimethylamino)propoxy]phenyl]sulfonylindol-2-yl]-4-hydroxycyclohexa-2,5-dien-1-one Traditional Name: 4-[1-[4-[3-(dimethylamino)propoxy]phenyl]sulfonylindol-2-yl]-4-hydroxy-cyclohexa-2,5-dien-1-one Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C4(C=CC(=O)C=C4)O

Isomeric SMILES

CN(C)CCCOC1=CC=C(C=C1)S(=O)(=O)N2C3=CC=CC=C3C=C2C4(C=CC(=O)C=C4)O

InChI

InChI=1S/C25H26N2O5S/c1-26(2)16-5-17-32-21-8-10-22(11-9-21)33(30,31)27-23-7-4-3-6-19(23)18-24(27)25(29)14-12-20(28)13-15-25/h3-4,6-15,18,29H,5,16-17H2,1-2H3