2H-chromen-3-yl-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2H-chromen-3-yl-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 2H-chromen-3-yl-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 2H-1-benzopyran-3-yl-[4-(3,4-diethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 2H-chromen-3-yl-[4-(3,4-diethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: 2H-chromen-3-yl-[4-(3,4-diethoxyphenyl)sulfonylpiperazino]methanone Formula: C24H28N2O6S MolecularWeight: 472.55392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4OC3)OCC

InChI

InChI=1S/C24H28N2O6S/c1-3-30-22-10-9-20(16-23(22)31-4-2)33(28,29)26-13-11-25(12-14-26)24(27)19-15-18-7-5-6-8-21(18)32-17-19/h5-10,15-16H,3-4,11-14,17H2,1-2H3