6-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]sulfonylchromen-2-one

Systemtic Name: 6-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]sulfonylchromen-2-one Openeye Name: 6-[[4-[2-(p-tolyl)ethyl]-1-piperidyl]sulfonyl]chromen-2-one CAS Name: 6-[[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]sulfonyl]-1-benzopyran-2-one IUPAC Name: 6-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]sulfonylchromen-2-one Traditional Name: 6-[4-[2-(p-tolyl)ethyl]piperidino]sulfonylcoumarin Formula: C23H25NO4S MolecularWeight: 411.5139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OC(=O)C=C4

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OC(=O)C=C4

InChI

InChI=1S/C23H25NO4S/c1-17-2-4-18(5-3-17)6-7-19-12-14-24(15-13-19)29(26,27)21-9-10-22-20(16-21)8-11-23(25)28-22/h2-5,8-11,16,19H,6-7,12-15H2,1H3