8-ethoxy-5-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-quinoline

Systemtic Name: 8-ethoxy-5-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-quinoline Openeye Name: 8-ethoxy-5-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-quinoline CAS Name: 8-ethoxy-5-[[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-ethoxy-5-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonylquinoline Traditional Name: 8-ethoxy-5-(4-o-phenetylpiperazino)sulfonyl-quinoline Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4OCC)C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4OCC)C=CC=N2

InChI

InChI=1S/C23H27N3O4S/c1-3-29-20-10-6-5-9-19(20)25-14-16-26(17-15-25)31(27,28)22-12-11-21(30-4-2)23-18(22)8-7-13-24-23/h5-13H,3-4,14-17H2,1-2H3