N-(4-methyl-2-morpholin-4-yl-pentyl)-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-(4-methyl-2-morpholin-4-yl-pentyl)-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-(4-methyl-2-morpholino-pentyl)-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-[4-methyl-2-(4-morpholinyl)pentyl]-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-(4-methyl-2-morpholin-4-ylpentyl)-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: (4-methyl-2-morpholino-pentyl)-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C21H34N4O5S MolecularWeight: 454.58346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC(C)CC(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C21H34N4O5S/c1-17(2)14-18(23-10-12-30-13-11-23)16-22-20-7-6-19(15-21(20)25(26)27)31(28,29)24-8-4-3-5-9-24/h6-7,15,17-18,22H,3-5,8-14,16H2,1-2H3