4-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[(2R)-2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C21H30N4O5S MolecularWeight: 450.5517

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=C(C=C2)OC)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NC[C@@H](C2=CC=C(C=C2)OC)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O5S/c1-6-24(7-2)31(28,29)18-12-13-19(20(14-18)25(26)27)22-15-21(23(3)4)16-8-10-17(30-5)11-9-16/h8-14,21-22H,6-7,15H2,1-5H3/t21-/m0/s1