3-[6-(3-oxidanylpropoxy)-1-(phenylsulfonyl)indol-4-yl]-1-propyl-piperidin-2-one

Systemtic Name: 3-[6-(3-oxidanylpropoxy)-1-(phenylsulfonyl)indol-4-yl]-1-propyl-piperidin-2-one Openeye Name: 3-[1-(benzenesulfonyl)-6-(3-hydroxypropoxy)indol-4-yl]-1-propyl-piperidin-2-one CAS Name: 3-[1-(benzenesulfonyl)-6-(3-hydroxypropoxy)-4-indolyl]-1-propyl-2-piperidinone IUPAC Name: 3-[1-(benzenesulfonyl)-6-(3-hydroxypropoxy)indol-4-yl]-1-propylpiperidin-2-one Traditional Name: 3-[1-besyl-6-(3-hydroxypropoxy)indol-4-yl]-1-propyl-2-piperidone Formula: C25H30N2O5S MolecularWeight: 470.5811

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCC(C1=O)C2=CC(=CC3=C2C=CN3S(=O)(=O)C4=CC=CC=C4)OCCCO

Isomeric SMILES

CCCN1CCCC(C1=O)C2=CC(=CC3=C2C=CN3S(=O)(=O)C4=CC=CC=C4)OCCCO

InChI

InChI=1S/C25H30N2O5S/c1-2-12-26-13-6-10-22(25(26)29)23-17-19(32-16-7-15-28)18-24-21(23)11-14-27(24)33(30,31)20-8-4-3-5-9-20/h3-5,8-9,11,14,17-18,22,28H,2,6-7,10,12-13,15-16H2,1H3