N2,N2,4-trimethyl-N1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)pentane-1,2-diamine

Systemtic Name: N2,N2,4-trimethyl-N1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)pentane-1,2-diamine Openeye Name: N2,N2,4-trimethyl-N1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]pentane-1,2-diamine CAS Name: N2,N2,4-trimethyl-N1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]pentane-1,2-diamine IUPAC Name: 2-N,2-N,4-trimethyl-1-N-(2-nitro-4-piperidin-1-ylsulfonylphenyl)pentane-1,2-diamine Traditional Name: dimethyl-[3-methyl-1-[(2-nitro-4-piperidinosulfonyl-anilino)methyl]butyl]amine Formula: C19H32N4O4S MolecularWeight: 412.54678

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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-])N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4O4S/c1-15(2)12-16(21(3)4)14-20-18-9-8-17(13-19(18)23(24)25)28(26,27)22-10-6-5-7-11-22/h8-9,13,15-16,20H,5-7,10-12,14H2,1-4H3