[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone

Systemtic Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-quinolin-2-yl-methanone Openeye Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(2-quinolyl)methanone CAS Name: [4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-(2-quinolinyl)methanone IUPAC Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-quinolin-2-ylmethanone Traditional Name: [4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-(2-quinolyl)methanone Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C22H23N3O5S/c1-29-20-10-8-17(15-21(20)30-2)31(27,28)25-13-11-24(12-14-25)22(26)19-9-7-16-5-3-4-6-18(16)23-19/h3-10,15H,11-14H2,1-2H3