4-[bis(2-ethylhexyl)amino]-N,N-bis(2-ethylhexyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-[bis(2-ethylhexyl)amino]-N,N-bis(2-ethylhexyl)-3-nitro-benzenesulfonamide Openeye Name: 4-[bis(2-ethylhexyl)amino]-N,N-bis(2-ethylhexyl)-3-nitro-benzenesulfonamide CAS Name: 4-[bis(2-ethylhexyl)amino]-N,N-bis(2-ethylhexyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-[bis(2-ethylhexyl)amino]-N,N-bis(2-ethylhexyl)-3-nitrobenzenesulfonamide Traditional Name: 4-[bis(2-ethylhexyl)amino]-N,N-bis(2-ethylhexyl)-3-nitro-benzenesulfonamide Formula: C38H71N3O4S MolecularWeight: 666.05304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(CC(CC)CCCC)C1=C(C=C(C=C1)S(=O)(=O)N(CC(CC)CCCC)CC(CC)CCCC)[N+](=O)[O-]

Isomeric SMILES

CCCCC(CC)CN(CC(CC)CCCC)C1=C(C=C(C=C1)S(=O)(=O)N(CC(CC)CCCC)CC(CC)CCCC)[N+](=O)[O-]

InChI

InChI=1S/C38H71N3O4S/c1-9-17-21-32(13-5)28-39(29-33(14-6)22-18-10-2)37-26-25-36(27-38(37)41(42)43)46(44,45)40(30-34(15-7)23-19-11-3)31-35(16-8)24-20-12-4/h25-27,32-35H,9-24,28-31H2,1-8H3