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

Systemtic Name: 8-ethoxy-5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-quinoline Openeye Name: 8-ethoxy-5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonyl-quinoline CAS Name: 8-ethoxy-5-[[4-(4-nitrophenyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-ethoxy-5-[4-(4-nitrophenyl)piperazin-1-yl]sulfonylquinoline Traditional Name: 8-ethoxy-5-[4-(4-nitrophenyl)piperazino]sulfonyl-quinoline Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C=CC=N2

Isomeric SMILES

CCOC1=C2C(=C(C=C1)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])C=CC=N2

InChI

InChI=1S/C21H22N4O5S/c1-2-30-19-9-10-20(18-4-3-11-22-21(18)19)31(28,29)24-14-12-23(13-15-24)16-5-7-17(8-6-16)25(26)27/h3-11H,2,12-15H2,1H3