[(2S)-1-[(2,5-dimethoxyphenyl)sulfonylamino]-3-phenyl-propan-2-yl]-diethyl-azanium

Systemtic Name: [(2S)-1-[(2,5-dimethoxyphenyl)sulfonylamino]-3-phenyl-propan-2-yl]-diethyl-azanium Openeye Name: [(1S)-1-benzyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]ethyl]-diethyl-ammonium CAS Name: [(2S)-1-[(2,5-dimethoxyphenyl)sulfonylamino]-3-phenylpropan-2-yl]-diethylammonium IUPAC Name: [(2S)-1-[(2,5-dimethoxyphenyl)sulfonylamino]-3-phenylpropan-2-yl]-diethylazanium Traditional Name: [(1S)-1-benzyl-2-[(2,5-dimethoxyphenyl)sulfonylamino]ethyl]-diethyl-ammonium Formula: C21H31N2O4S+ MolecularWeight: 407.54684

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CC1=CC=CC=C1)CNS(=O)(=O)C2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CC[NH+](CC)[C@@H](CC1=CC=CC=C1)CNS(=O)(=O)C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C21H30N2O4S/c1-5-23(6-2)18(14-17-10-8-7-9-11-17)16-22-28(24,25)21-15-19(26-3)12-13-20(21)27-4/h7-13,15,18,22H,5-6,14,16H2,1-4H3/p+1/t18-/m0/s1