5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-8-ethoxy-quinoline

Systemtic Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-8-ethoxy-quinoline Openeye Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-8-ethoxy-quinoline CAS Name: 5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-8-ethoxyquinoline IUPAC Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-8-ethoxyquinoline Traditional Name: 5-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-8-ethoxy-quinoline Formula: C23H27N3O3S MolecularWeight: 425.54378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC=CC(=C4C)C)C=CC=N2

InChI

InChI=1S/C23H27N3O3S/c1-4-29-21-10-11-22(19-8-6-12-24-23(19)21)30(27,28)26-15-13-25(14-16-26)20-9-5-7-17(2)18(20)3/h5-12H,4,13-16H2,1-3H3