N2,N2-diethyl-4-methyl-N1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)pentane-1,2-diamine

Systemtic Name: N2,N2-diethyl-4-methyl-N1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)pentane-1,2-diamine Openeye Name: N2,N2-diethyl-4-methyl-N1-(4-morpholinosulfonyl-2-nitro-phenyl)pentane-1,2-diamine CAS Name: N2,N2-diethyl-4-methyl-N1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]pentane-1,2-diamine IUPAC Name: 2-N,2-N-diethyl-4-methyl-1-N-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)pentane-1,2-diamine Traditional Name: diethyl-[3-methyl-1-[(4-morpholinosulfonyl-2-nitro-anilino)methyl]butyl]amine Formula: C20H34N4O5S MolecularWeight: 442.57276

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CC(C)C)CNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(CC(C)C)CNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C20H34N4O5S/c1-5-22(6-2)17(13-16(3)4)15-21-19-8-7-18(14-20(19)24(25)26)30(27,28)23-9-11-29-12-10-23/h7-8,14,16-17,21H,5-6,9-13,15H2,1-4H3