4-[(2-cyclopentyloxypyridin-3-yl)methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[(2-cyclopentyloxypyridin-3-yl)methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[2-(cyclopentoxy)-3-pyridyl]methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(2-cyclopentyloxy-3-pyridinyl)methylamino]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[(2-cyclopentyloxypyridin-3-yl)methylamino]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[2-(cyclopentoxy)-3-pyridyl]methylamino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=C(N=CC=C2)OC3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC2=C(N=CC=C2)OC3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O5S/c1-3-24(4-2)31(28,29)18-11-12-19(20(14-18)25(26)27)23-15-16-8-7-13-22-21(16)30-17-9-5-6-10-17/h7-8,11-14,17,23H,3-6,9-10,15H2,1-2H3