4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-(2-quinolin-8-ylethyl)aniline

Systemtic Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-(2-quinolin-8-ylethyl)aniline Openeye Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-[2-(8-quinolyl)ethyl]aniline CAS Name: 4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitro-N-[2-(8-quinolinyl)ethyl]aniline IUPAC Name: 4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-N-(2-quinolin-8-ylethyl)aniline Traditional Name: [4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]-[2-(8-quinolyl)ethyl]amine Formula: C22H25N5O4S MolecularWeight: 455.53

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N5O4S/c1-25-12-14-26(15-13-25)32(30,31)19-7-8-20(21(16-19)27(28)29)23-11-9-18-5-2-4-17-6-3-10-24-22(17)18/h2-8,10,16,23H,9,11-15H2,1H3